HIT ID: HIT212666484
Cas No:
分子式: C19H25F3N6O6
分子量: 490.44
常用名: PGlu-3-methyl-His-Pro-NH2 TFA
氢键受体数 (HBA): 5
氢键供体数 (HBD): 3
LogP: -3.0441527
IUPAC: (2S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1-methyl-1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide; trifluoroacetic acid
IUPAC: (2S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1-methyl-1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide; trifluoroacetic acid
SMILES: OC(=O)C(F)(F)F.Cn1cncc1C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(N)=O
SMILES: OC(=O)C(F)(F)F.Cn1cncc1C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(N)=O
InChI key: XHROLUALQYBURQ-QKWXXBCPSA-N
