PF-AKT400
HIT212661212
sdf文件结构编辑类似物检索
HIT ID: HIT212661212
Cas No: 1004990-28-6
分子式: C20H22F2N6O
分子量: 400.434
常用名: PF-AKT400
氢键受体数 (HBA): 5
氢键供体数 (HBD): 3
LogP: 2.4128788
IUPAC: N-{[(3S)-3-amino-1-{5-ethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}pyrrolidin-3-yl]methyl}-2,4-difluorobenzamide
IUPAC: N-{[(3S)-3-amino-1-{5-ethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}pyrrolidin-3-yl]methyl}-2,4-difluorobenzamide
SMILES: CCc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(F)cc4F)C3)c12
SMILES: CCc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(F)cc4F)C3)c12
InChI key: MOZRQQTUYAYCQT-FQEVSTJZSA-N
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