['CO', 'CC1=C(C=O)[C@@H](c2cn(-c3ccccc3)nc2-c2ccccc2)N2C(=O)CCSC2=N1', 'c1ccccc1', 'COC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1c[nH]nc1-c1ccccc1', 'COC(=O)C1=C(C)N=C2SCCC(=O)N2C1', 'c1ccc(-c2ccn(-c3ccccc3)n2)cc1', 'COC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1cnn(-c2ccccc2)c1']
The molecule <smiles>COC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1cn(-c2ccccc2)nc1-c1ccccc1</smiles> has a molecular weight of <MW> 436.3670000000003</MW>, a tPSA of <tPSA> 76.78999999999999</tPSA>, a CLogP of <CLogP> 4.362500000000003</CLogP>, and contains <HBA> 7</HBA> hydrogen bond acceptors (HBA), <HBD> 0</HBD> hydrogen bond donors (HBD), and <rotateable bonds> 4</rotateable bonds> rotatable bonds.