2-({4-[(3H-imidazol-4-ylmethyl)amino]-2-(naphthalen-1-yl)phenyl}formamido)-4-methylpentanoic acid; trifluoroacetic acid, GGTI 2133 TFA
HIT218832902
sdf文件结构编辑类似物检索
HIT ID: HIT218832902
Cas No:
分子式: C29H29F3N4O5
分子量: 570.569
常用名: 2-({4-[(3H-imidazol-4-ylmethyl)amino]-2-(naphthalen-1-yl)phenyl}formamido)-4-methylpentanoic acid; trifluoroacetic acid, GGTI 2133 TFA
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(4-{[(1H-imidazol-5-yl)methyl]amino}-2-(naphthalen-1-yl)phenyl)formamido]-4-methylpentanoic acid; trifluoroacetic acid
SMILES: OC(=O)C(F)(F)F.CC(C)CC(NC(=O)c1ccc(NCc2cnc[nH]2)cc1-c1cccc2ccccc12)C(O)=O
InChI key: FXXUNOYBYJFSRB-UHFFFAOYSA-N
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