['O=Cc1ccc(Br)s1', 'CC(C)(C)c1cc(N)n([C@@H]2CCS(=O)(=O)C2)n1', 'NC(=O)c1ccc(Br)s1', 'CC(C)(C)c1ccn([C@@H]2CCS(=O)(=O)C2)n1', 'Brc1cccs1', 'CC(C)(C)c1cc(NC=O)n([C@@H]2CCS(=O)(=O)C2)n1', 'CC(C)C', 'O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1ccc(Br)s1', 'O=S1(=O)CCCC1', 'CC(C)(C)c1cc(NC(=O)c2ccc(Br)s2)[nH]n1']
The molecule <smiles>CC(C)(C)c1cc(NC(=O)c2ccc(Br)s2)n([C@@H]2CCS(=O)(=O)C2)n1</smiles> has a molecular weight of <MW> 426.23200000000014</MW>, a tPSA of <tPSA> 81.06</tPSA>, a CLogP of <CLogP> 3.616500000000002</CLogP>, and contains <HBA> 6</HBA> hydrogen bond acceptors (HBA), <HBD> 1</HBD> hydrogen bond donors (HBD), and <rotateable bonds> 3</rotateable bonds> rotatable bonds.