CDD-1819
HIT218851305
sdf文件结构编辑类似物检索
HIT ID: HIT218851305
Cas No: 2894104-40-4
分子式: C35H31N5O2
分子量: 553.666
常用名: CDD-1819
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-(isoquinolin-4-yl)-N-[(1S)-1-(naphthalen-2-yl)ethyl]-1-[(1r,3r)-3-(methylcarbamoyl)cyclobutyl]-1H-1,3-benzodiazole-7-carboxamide
IUPAC: 2-(isoquinolin-4-yl)-N-[(1S)-1-(naphthalen-2-yl)ethyl]-1-[(1r,3r)-3-(methylcarbamoyl)cyclobutyl]-1H-1,3-benzodiazole-7-carboxamide
SMILES: CNC(=O)[C@H]1C[C@@H](C1)n1c(nc2cccc(C(=O)N[C@@H](C)c3ccc4ccccc4c3)c12)-c1cncc2ccccc12
SMILES: CNC(=O)[C@H]1C[C@@H](C1)n1c(nc2cccc(C(=O)N[C@@H](C)c3ccc4ccccc4c3)c12)-c1cncc2ccccc12
InChI key: YXZCMQAWBHCPMS-PUUVEUEGSA-N
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