HIT ID: HIT218676503
Cas No: 245443-51-0
分子式: C28H42N8O8
分子量: 618.692
常用名: (2S)-2-(2-{[(2S)-1-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanoyl]pyrrolidin-2-yl]formamido}acetamido)-N-[(1S)-1-carbamoyl-2-methylpropyl]pentanediamide, PAR-4 (1-6) amide (human)
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-2-(2-{[(2S)-1-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanoyl]pyrrolidin-2-yl]formamido}acetamido)-N-[(1S)-1-carbamoyl-2-methylpropyl]pentanediamide
SMILES: CC(C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(N)=O
InChI key: NIUWXNGGQOLCDN-XHOYROJHSA-N