HIT ID: HIT212666414
Cas No: 2084811-68-5
分子式: C24H27N7O7S
分子量: 557.58
常用名: PARP14 inhibitor H10
氢键受体数 (HBA): 9
氢键供体数 (HBD): 5
LogP: -0.31785473
IUPAC: 3-({2-[4-(2-{3-[(3-carbamoylphenyl)carbamoyl]propanamido}ethyl)-1H-1,2,3-triazol-1-yl]ethyl}sulfamoyl)benzoic acid
IUPAC: 3-({2-[4-(2-{3-[(3-carbamoylphenyl)carbamoyl]propanamido}ethyl)-1H-1,2,3-triazol-1-yl]ethyl}sulfamoyl)benzoic acid
SMILES: NC(=O)c1cccc(NC(=O)CCC(=O)NCCc2cn(CCNS(=O)(=O)c3cccc(c3)C(O)=O)nn2)c1
SMILES: NC(=O)c1cccc(NC(=O)CCC(=O)NCCc2cn(CCNS(=O)(=O)c3cccc(c3)C(O)=O)nn2)c1
InChI key: MUOMSHSMJCWQFH-UHFFFAOYSA-N
