HIT ID: HIT218851056
Cas No: 2951090-00-7
分子式: C28H32ClN7O3S
分子量: 582.12
常用名: SIRT5 inhibitor 7
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-({[3-({2-[(2-chlorophenyl)amino]-5-[(3R)-3-phenylpyrrolidine-1-carbonyl]pyrimidin-4-yl}amino)propyl]carbamothioyl}amino)propanoic acid
IUPAC: 3-({[3-({2-[(2-chlorophenyl)amino]-5-[(3R)-3-phenylpyrrolidine-1-carbonyl]pyrimidin-4-yl}amino)propyl]carbamothioyl}amino)propanoic acid
SMILES: OC(=O)CCNC(=S)NCCCNc1nc(Nc2ccccc2Cl)ncc1C(=O)N1CC[C@@H](C1)c1ccccc1
SMILES: OC(=O)CCNC(=S)NCCCNc1nc(Nc2ccccc2Cl)ncc1C(=O)N1CC[C@@H](C1)c1ccccc1
InChI key: YVUGRSDTNXBWNT-FQEVSTJZSA-N