molecule_id,smiles Aspirin,CC(=O)Oc1ccccc1C(=O)O Acetaminophen,CC(=O)Nc1ccc(O)cc1 Ibuprofen,CC(C)Cc1ccc(cc1)C(C)C(=O)O Metformin,CN(C)C(=N)NC(=N)N Benzamide,NC(=O)c1ccccc1 Acetanilide,CC(=O)Nc1ccccc1 Salicylic acid,O=C(O)c1ccccc1O N-Propylbenzamide,CCCNC(=O)c1ccccc1 Indole,c1ccc2[nH]ccc2c1 Coumarin,O=c1oc2ccccc2cc1 Quinoline,c1ccc2ncccc2c1 Benzothiazole,c1ccc2ncsc2c1