GSK3145095
HIT212661129
sdf文件结构编辑类似物检索
HIT ID: HIT212661129
Cas No: 1622849-43-7
分子式: C20H17F2N5O2
分子量: 397.386
常用名: GSK3145095
氢键受体数 (HBA): 4
氢键供体数 (HBD): 3
LogP: 3.2984502
IUPAC: 5-benzyl-N-[(3S)-7,9-difluoro-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl]-1H-1,2,4-triazole-3-carboxamide
IUPAC: 5-benzyl-N-[(3S)-7,9-difluoro-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl]-1H-1,2,4-triazole-3-carboxamide
SMILES: Fc1cc(F)c2NC(=O)[C@H](CCc2c1)NC(=O)c1n[nH]c(Cc2ccccc2)n1
SMILES: Fc1cc(F)c2NC(=O)[C@H](CCc2c1)NC(=O)c1n[nH]c(Cc2ccccc2)n1
InChI key: ATQAGKAMBISZQM-HNNXBMFYSA-N
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