HIT ID: HIT212669453
Cas No: 37106-97-1
分子式: C23H20N2O5
分子量: 404.422
常用名: Bentiromide
氢键受体数 (HBA): 5
氢键供体数 (HBD): 4
LogP: 3.5389557
IUPAC: 4-[(2S)-3-(4-hydroxyphenyl)-2-(phenylformamido)propanamido]benzoic acid
IUPAC: 4-[(2S)-3-(4-hydroxyphenyl)-2-(phenylformamido)propanamido]benzoic acid
SMILES: OC(=O)c1ccc(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)c2ccccc2)cc1
SMILES: OC(=O)c1ccc(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)c2ccccc2)cc1
InChI key: SPPTWHFVYKCNNK-FQEVSTJZSA-N