LY 233536
HIT212713142
sdf文件结构编辑类似物检索
HIT ID: HIT212713142
Cas No: 136845-59-5
分子式: C12H19N5O2
分子量: 265.317
常用名: LY 233536
氢键受体数 (HBA): 6
氢键供体数 (HBD): 3
LogP: -2.0745263
IUPAC: (3R,4aS,6R,8aS)-6-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-decahydroisoquinoline-3-carboxylic acid
IUPAC: (3R,4aS,6R,8aS)-6-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-decahydroisoquinoline-3-carboxylic acid
SMILES: [H][C@]12CC[C@@H](Cc3nnn[nH]3)C[C@@]1([H])C[C@@H](NC2)C(O)=O
SMILES: [H][C@]12CC[C@@H](Cc3nnn[nH]3)C[C@@]1([H])C[C@@H](NC2)C(O)=O
InChI key: ACTONBBIVMTUAJ-DOLQZWNJSA-N
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