['CO', 'N#CC(C(=O)Cn1c(=O)cnc2ccccc21)c1nc(-c2ccccc2)cs1', 'O=c1cnc2ccccc2[nH]1', 'COc1ccc(-c2csc(C(C#N)C(C)=O)n2)cc1', 'COc1ccc(-c2cscn2)cc1', 'N#CCC(=O)Cn1c(=O)cnc2ccccc21', 'COc1ccccc1', 'N#CC(C(=O)Cn1c(=O)cnc2ccccc21)c1nccs1']
The molecule <smiles>COc1ccc(-c2csc(C(C#N)C(=O)Cn3c(=O)cnc4ccccc43)n2)cc1</smiles> has a molecular weight of <MW> 400.3340000000002</MW>, a tPSA of <tPSA> 97.87</tPSA>, a CLogP of <CLogP> 3.4050800000000025</CLogP>, and contains <HBA> 8</HBA> hydrogen bond acceptors (HBA), <HBD> 0</HBD> hydrogen bond donors (HBD), and <rotateable bonds> 6</rotateable bonds> rotatable bonds.