['CC(C)[C@](C)(N)C#N', 'COc1ccccc1-n1c(S[C@@H](C)C=O)nnc1N1CCCCC1', 'CO', 'CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)Sc1nnc(N2CCCCC2)n1-c1ccccc1', 'CC(C)[C@H](C)C#N', 'COc1ccccc1-n1c(S[C@@H](C)C(N)=O)nnc1N1CCCCC1', 'CCC(=O)N[C@](C)(C#N)C(C)C', 'COc1ccccc1-n1c(S)nnc1N1CCCCC1', 'C1CCNCC1', 'COc1ccccc1-n1cnnc1S[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C', 'COc1ccccc1', 'CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)Sc1nnc(N2CCCCC2)[nH]1', 'CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)S', 'COc1ccccc1-n1cnnc1N1CCCCC1']
The molecule <smiles>COc1ccccc1-n1c(S[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)nnc1N1CCCCC1</smiles> has a molecular weight of <MW> 424.3600000000002</MW>, a tPSA of <tPSA> 96.07</tPSA>, a CLogP of <CLogP> 3.801280000000003</CLogP>, and contains <HBA> 8</HBA> hydrogen bond acceptors (HBA), <HBD> 1</HBD> hydrogen bond donors (HBD), and <rotateable bonds> 8</rotateable bonds> rotatable bonds.