Datasets:

ChemistryVision

/

Clintox-V-SELFIE

like 0

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][NH1+1][C][C][C@][C][=C][C][=C][C][=Branch2][Ring1][Branch2][=C][Ring1][=Branch1][O][C@H1][Ring1][=Branch2][C][=Branch1][C][=O][C][C][C@H1][Ring1][=C][C@H1][Ring2][Ring1][C][C][Ring1][=C][O][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][NH1][C][=Branch1][C][=O][N][Ring1][Branch2][C@H1][C][C@@H1][Branch1][=Branch2][C@H1][Branch1][Ring2][O][Ring1][Branch1][C][O][O][F] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][C][=Branch1][=N][=C][S][C][=Ring1][Branch1][C][=Branch1][Ring2][=C][Ring1][=Branch2][Cl][C][O][C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][C@H1][Branch2][Branch2][=N][C][=Branch1][C][=O][C@@][Branch2][Branch2][Ring2][C@H1][Branch2][#Branch1][=C][C][C@@H1][C@][Branch2][=Branch1][O][C@H1][Ring1][=Branch1][C@@H1][Branch2][Branch1][#Branch1][C@@][Branch1][Branch2][C][Ring1][=N][Branch1][C][C][C][Branch2][Ring2][=Branch2][C][C@@H1][Ring2][Ring1][C][O][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][#Branch2][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][O][O][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch1][C][O][Ring2][Ring2][#Branch2][O][C][=Branch1][C][=O][C][O][C][C][O][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][Branch1][C][C][NH2+1][C][C][Branch1][#C][C][=C][C][=Branch1][=Branch2][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][O][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][C][=Branch1][C][=O][C][C][Branch1][Branch1][C][Ring1][=Branch1][=O][C][=C][C][=C][C][=C][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C@][C][C][C@H1][C@H1][Branch1][=C][C@@H1][Ring1][=Branch1][C][C][C@][Ring1][=Branch2][Branch1][Ring1][C][#C][O][C][C][C][=C][C][=Branch1][C][=O][C][C][C@H1][Ring2][Ring1][C][Ring1][#Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch1][#Branch2][C][Branch1][=Branch1][C][=Branch1][C][=O][O-1][S][Branch1][=Branch1][C][=Branch1][C][=O][O-1][S] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][C][=Branch1][C][=O][C][=C][C][=Branch1][=Branch1][=C][C][=N][Ring1][=Branch1][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][Branch1][S][C][=Branch1][C][=O][N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O-1][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][O][C][C][Branch1][C][C][NH1+1][Branch1][C][C][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@][C][C][C@@H1][C][=C][C][=C][Branch2][Ring1][O][C][=C][Ring1][=Branch1][C][C][C@H1][Ring1][#Branch2][C@@H1][Ring1][=C][C][C][C@@H1][Ring1][P][O][P][=Branch1][C][=O][Branch1][C][O-1][O-1][O][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][Cl][C][C][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=N][N][=C][Branch1][Ring2][S][Ring1][Branch1][S][C][C][=C][Branch2][Ring1][#C][N][C@@H1][Branch2][Ring1][Branch1][C@@H1][Branch1][Branch1][C][Ring1][Ring2][=O][N][C][=Branch1][C][=O][C][N][C][=N][N][=N][Ring1][Branch1][S][C][Ring2][Ring1][C][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][N][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][NH1+1][C][C][C@@][C][=C][C@@H1][Branch2][Ring1][Branch2][C][C@@H1][Ring1][=Branch1][O][C][=C][Ring1][=Branch2][C][=Branch1][Branch2][=C][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][Ring1][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][=C][Ring1][Branch1][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][C][Ring1][#Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=N][C][=C][Branch2][Ring1][Branch1][N][Ring1][Branch1][C@H1][C@H1][Branch1][=N][C@@H1][Branch1][=Branch2][C@H1][Branch1][Ring2][O][Ring1][Branch1][C][O][O][F][N][=C][Branch1][=Branch1][N][=C][Ring1][S][N][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C][N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][C][NH1+1][Branch2][Ring1][N][C@@H1][C][C][=C][N][Branch2][Ring1][Ring1][C][=C][Ring1][Branch1][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=C][Ring1][S][C][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][N][C][=C][C][=Branch2][Ring1][#Branch1][=C][Branch1][N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][S][=Branch1][C][=O][=Branch1][C][=O][N][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch1][#Branch2][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][Cl][Cl][C][O][C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C@@H1][C][C@H1][Branch1][Branch2][NH1+1][Branch1][Ring2][C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch1][C@@H1][C@@H1][Branch1][P][C@@H1][Branch1][=N][C@H1][Branch1][=Branch2][C@H1][Branch1][Ring2][O][Ring1][=Branch1][S][C][O][O][O][C][Branch1][C][C][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N-1][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][#Branch2][C][N+1][Branch1][C][C][Branch1][C][C][C][O][C][=Branch1][C][=O][N] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][Branch1][C][C][N][/N][=C][\C][=Branch1][=Branch1][=N][C][=N][/-Ring1][Branch1][C][=Branch1][C][=O][N] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=Branch1][=Branch1][=C][Branch1][C][F][F][Branch1][C][F][F] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][N][C][=C][C][=Branch2][Ring1][#Branch2][=C][Branch1][#C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][C][F][Branch1][C][F][F] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][O][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][O][C][C][NH1+1][Branch1][Ring1][C][C][C][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][C][=Branch2][Ring2][Branch2][=N][C][=Branch1][Ring2][=N][Ring1][=Branch1][O][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O-1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=Branch1][Branch2][=C][Branch1][Ring2][NH1][Ring1][=Branch1][C][N][/N][=C][\C][=C][C][=C][Branch1][Branch1][C][/-Ring1][=Branch1][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch2][Branch2][Ring1][N][Branch1][Ring2][C][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C@H1][Branch2][Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][#Branch2][C][C][C][NH1+1][=C][Branch1][C][N][N][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch2][C][C][C][NH1+1][=C][Branch1][C][N][N][NH3+1][O][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][C][Ring1][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][NH1+1][=C][Branch1][C][N][N][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@][C][C@@H1][Branch2][Ring2][#C][C@][Branch2][Ring2][#Branch2][C@H1][Branch2][Ring1][Branch1][C@@H1][Ring1][=Branch1][C][C@H1][Branch1][=N][C@@][Ring1][=Branch2][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][O][C][C][C][=C][C][=Branch1][C][=O][C][=C][C@@][Ring1][#Branch1][Ring2][Ring1][Branch1][C][F][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch2][Ring1][Ring1][C@H1][Branch1][#C][C@H1][Branch1][O][C@@H1][Branch1][#Branch1][C@H1][Branch1][Ring1][C][O][O][O][O][O][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][C@H1][C@@H1][N][Branch1][Branch1][C][Ring1][Ring2][=O][C@H1][Branch1][O][C][Branch1][Ring2][S][Ring1][#Branch1][Branch1][C][C][C][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch2][Ring1][C][=N][N][=C][Ring1][#Branch1][N][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][C][C][=C][C][=N][C][=C][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [O-1][S][=Branch1][C][=O][=Branch1][C][=S][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@H1][C][C@H1][C@@H1][C][C][C][=C][C][=Branch1][C][=O][C][=C][C@@][Ring1][#Branch1][Branch2][Ring2][=C][C@][Ring1][O][Branch2][Ring2][#Branch1][C@H1][Branch2][Ring2][C][C][C@@][Ring1][#C][Branch2][Ring1][#Branch2][C@][Ring2][Ring1][C][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][F][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][/C][=C][/C][=Branch1][C][=O][N][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][Branch1][=N][O][Ring1][=Branch1][C][S][=Branch1][C][=O][=Branch1][C][=O][N] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [O-1][S][=Branch1][C][=O][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][NH1][N][=C][Ring1][Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][Branch1][P][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][=Branch1][C][=O][C][C][=C][C][=C][C][=N][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][C][=Branch1][C][=O][O][C@H1][C][C][C@@H1][C@@][Ring1][Branch1][Branch2][Ring1][=Branch1][C][C][C@H1][C@H1][Ring1][=Branch1][C][C][C][=C][Ring1][=Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [O][=Ti][=O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][NH1+1][Branch1][C][C][C][C][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][/C][=Branch1][#C][=C][Branch1][Ring2][/C][C][Cl][\C][=C][C][=C][C][=C][Ring1][=Branch1][/C][=C][C][=C][C][=C][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [B][Branch2][Ring2][Branch2][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][N][=C][Ring1][=Branch1][Branch1][C][O][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][C][=Branch1][=N][=N][C][=Branch1][C][=O][C][=Branch1][C][=O][NH1][Ring1][Branch2][S][C][C][=C][Branch2][Ring2][#Branch1][N][C@@H1][Branch2][Ring1][=N][C@@H1][Branch1][Branch1][C][Ring1][Ring2][=O][N][C][=Branch1][C][=O][/C][=Branch1][Ring2][=N][\O][C][/C][=C][S][C][=Branch1][Ring2][=N][Ring1][Branch1][N][S][C][Ring2][Ring1][=Branch1][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][N][C][=C][C][=Branch1][=Branch1][=N][C][Ring1][=Branch1][=O][N-1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][N] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C][C@@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][NH1+1][=C][Branch1][C][N][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][C][C][=C][NH1][C][=C][Ring1][Branch1][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C][C][=C][NH1][C][=C][Ring1][Branch1][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][Cl][N][=O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][O][C][=C][C][=Branch1][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][NH1+1][Branch1][Ring1][C][C][C][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][NH1+1][Branch1][Ring1][C][C][C][C][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][/C][=Branch1][=N][=C][Branch1][=Branch2][/C][=C][C][=C][C][=C][Ring1][=Branch1][\Cl][/C][=C][C][=C][C][=C][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][=C][N][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][S][Ring1][#Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][Branch2][Ring1][=N][N][C][=Branch1][Branch1][=C][Ring1][Branch1][C][/C][=C][/C][=C][Branch1][#Branch2][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][F][N][C][\-Ring1][#Branch2][=O][C].[C][Branch1][#Branch2][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C][=Branch1][C][=O][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch1][N][Ring1][Branch1][C][C][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=Branch2][Ring1][=N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][Branch1][=C][C@H1][C@H1][Ring1][#Branch1][C][C][=Branch1][C][=O][C][C][Ring1][#Branch1][Branch1][C][C][C][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@H1][C@H1][C][C][C][=Branch1][S][=C][Branch1][Branch2][N][Ring1][=Branch1][C][Ring1][Branch2][=O][C][=Branch1][C][=O][O-1][Cl][NH3+1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][C][C][=Branch1][C][=O][O][C@@][Branch2][Ring1][P][C][C][C@@H1][C@@][Ring1][Branch1][Branch2][Ring1][#Branch1][C][C][C@H1][C@H1][Ring1][=Branch1][C][C][C][=C][C][=Branch1][C][=O][C][C][C@][Ring1][O][Ring1][#Branch1][C][C][C][=Branch1][C][=O][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch2][Ring1][#C][=C][C][=C][Ring1][=Branch1][C@@H1][C][C][NH2+1][C][C@H1][Ring1][=Branch1][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][F] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][N][Branch1][#Branch2][C][=Branch1][C][=O][N][=C][Ring1][#Branch1][N][C][C@@H1][Branch1][Ring1][C][O][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][O][C@@H1][C][C@H1][C@@H1][C][C][C][=C][C][=Branch1][C][=O][C][=C][C@@][Ring1][#Branch1][Branch2][Ring1][S][C@H1][Ring1][O][C@H1][Branch2][Ring1][Branch2][C][C@@][Ring1][#C][Branch1][P][C@@][Ring2][Ring1][C][Branch1][Branch1][O][Ring2][Ring1][Branch1][C][=Branch1][C][=O][C][O][C][O][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch2][Ring1][Branch1][O][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][F][Branch1][C][F][F][F] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][NH1+1][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][=C][Ring1][#Branch2][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@@H1][Branch1][S][C][N][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][Ring1][Branch2][NH1+1][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][Ring1][Branch2] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][/C][=Branch1][#Branch1][=C][\N+1][=Branch1][C][=O][O-1][/NH2+1][C][C][S][C][C][=C][C][=C][Branch1][Ring2][O][Ring1][Branch1][C][NH1+1][Branch1][C][C][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][NH1+1][Branch1][N][C][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch1][#Branch2][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][Cl][Cl][C][O][/N][=C][Branch1][=Branch2][/C][N][C][=C][N][=C][Ring1][Branch1][\C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][C][=C][Branch1][=N][C][=Branch1][C][=O][N][Branch1][Branch1][C][Ring1][#Branch1][=O][C][NH1][C][=N][Ring1][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][C][N][Branch2][Ring1][C][C][=N][C][=Branch1][C][=O][NH1][C][=Branch1][C][=O][C][Ring1][Branch2][=N][Ring1][#C][C][C@@H1][Branch1][O][C@@H1][Branch1][#Branch1][C@@H1][Branch1][Ring1][C][O][O][O][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@@H1][C@@H1][C@H1][Branch2][Branch1][C][C][=Branch1][C][=O][N][Ring1][Branch1][C][=Branch2][Ring2][C][=C][Ring1][Branch2][S][C@H1][C][C@H1][Branch1][Branch1][NH2+1][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][O-1][C][=Branch1][C][=O][O-1][C@@H1][Branch1][C][C][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][Branch1][#Branch2][C][C][NH1+1][C][C][C][C][Ring1][Branch1][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][C][NH1+1][Branch1][C][C][C][C][C][Branch1][C][O][Branch1][=Branch2][P][=Branch1][C][=O][Branch1][C][O-1][O-1][P][=Branch1][C][=O][Branch1][C][O-1][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][C][C@H1][Branch2][Branch1][=N][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][#Branch1][C][C][=C][Ring1][=Branch1][C][=Branch2][Ring1][=N][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][O-1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Branch2][=C][Ring1][=Branch1][C][Ring1][=N][=O][O][C][O-1][Branch1][=Branch1][C][=Branch1][C][=O][C][O][NH3+1][O] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][N][Branch2][Ring2][Branch2][C][C][N][Branch2][Ring1][#Branch1][C][C][N][Branch1][N][C][C][NH1+1][Ring1][N][C][C][=Branch1][C][=O][O-1][C][C][=Branch1][C][=O][O-1][C][Branch1][Ring1][C][O][C][Branch1][Ring1][C][O][O][C][C][=Branch1][C][=O][O-1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][O][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][=Branch2][N][C][C][C][NH1+1][Branch1][Branch1][C][C][Ring1][#Branch1][C] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C@@H1][Branch2][Ring1][O][C][=Branch1][C][=O][O][C][C][O][C][N][C][=N][C][=C][Ring1][Branch1][N][C][=Branch1][=Branch1][=N][C][Ring1][=Branch1][=O][N][N] Toxic: You have to predict whether it is Toxic with answer Yes or No.

no

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically whether a molecule is Clinically-trail-Toxic (Yes) or Not Clinically-trail-toxic (No) based on the SELFIE string representation of each molecule. The FDA-approved status will specify if the drug is approved by the FDA for clinical trials (Yes) or Not approved by the FDA for clinical trials (No). You will be provided with task template. The task is to predict the binary label for a given molecule, please answer with only Yes or No. SELFIE: [C][C@H1][Branch1][=N][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][NH3+1] Toxic: Yes SELFIE: [C][C][N][C][C][Branch2][Ring1][#Branch2][C][Branch1][Branch1][C][Ring1][Branch1][=O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][NH1+1][C][C][O][C][C][Ring1][=Branch1] Toxic: Yes SELFIE: [C][C][C][=Branch1][C][=O][N][C][=C][Ring1][#Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][Cl][Cl] Toxic: No SELFIE: [C][C@H1][C@H1][Branch2][=Branch1][Branch1][C@H1][Branch2][Branch1][S][C][C@@H1][Branch1][Ring2][O][Ring1][=Branch1][O][C@H1][C][C@@][Branch2][Ring2][=Branch2][C][C][=C][Branch2][Ring2][C][C][=C][Branch1][#Branch2][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][Branch1][C][Ring1][#Branch2][=O][C][=C][C][=C][Ring1][Branch2][O][C][O][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][N][O].[Cl] Toxic: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1+1][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Toxic: You have to predict whether it is Toxic with answer Yes or No.

yes