HIT ID: HIT214317434
Cas No: 101470-42-2
分子式: C29H40N4O6
分子量: 540.661
常用名: Collagenase inhibitor CI-2
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(1-{[2-(4-methoxyphenyl)-1-(methylcarbamoyl)ethyl]carbamoyl}-3-methylbutyl)amino]-4-(2-phenylacetamido)butanoic acid
IUPAC: 2-[(1-{[2-(4-methoxyphenyl)-1-(methylcarbamoyl)ethyl]carbamoyl}-3-methylbutyl)amino]-4-(2-phenylacetamido)butanoic acid
SMILES: CNC(=O)C(Cc1ccc(OC)cc1)NC(=O)C(CC(C)C)NC(CCNC(=O)Cc1ccccc1)C(O)=O
SMILES: CNC(=O)C(Cc1ccc(OC)cc1)NC(=O)C(CC(C)C)NC(CCNC(=O)Cc1ccccc1)C(O)=O
InChI key: CEZWBEWZEZTEHO-UHFFFAOYSA-N
