['CO', 'O=[N+]([O-])c1cnc(N2CCN(S(=O)(=O)c3ccccc3)CC2)nc1NC1CC1', 'COc1ccc([SH](=O)=O)cc1', 'O=[N+]([O-])c1cnc(N2CCNCC2)nc1NC1CC1', 'O=[N+]([O-])c1cncnc1NC1CC1', 'COc1ccc(S(=O)(=O)N2CCNCC2)cc1', 'NC1CC1', 'COc1ccc(S(=O)(=O)N2CCN(c3ncc([N+](=O)[O-])cn3)CC2)cc1', 'C1CC1', 'COc1ccc(S(=O)(=O)N2CCN(c3ncc([N+](=O)[O-])c(N)n3)CC2)cc1']
The molecule <smiles>COc1ccc(S(=O)(=O)N2CCN(c3ncc([N+](=O)[O-])c(NC4CC4)n3)CC2)cc1</smiles> has a molecular weight of <MW> 412.3020000000002</MW>, a tPSA of <tPSA> 130.8</tPSA>, a CLogP of <CLogP> 1.4785999999999992</CLogP>, and contains <HBA> 9</HBA> hydrogen bond acceptors (HBA), <HBD> 1</HBD> hydrogen bond donors (HBD), and <rotateable bonds> 7</rotateable bonds> rotatable bonds.