Ro 41-3290
HIT212670254
sdf文件结构编辑类似物检索
HIT ID: HIT212670254
Cas No: 143943-72-0
分子式: C24H21ClN2O3
分子量: 420.89
常用名: Ro 41-3290
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 2.1840267
IUPAC: 10-chloro-1-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-3-phenyl-4H,6H,7H-pyrido[2,1-a]isoquinolin-4-one
IUPAC: 10-chloro-1-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-3-phenyl-4H,6H,7H-pyrido[2,1-a]isoquinolin-4-one
SMILES: O[C@H]1CCN(C1)C(=O)c1cc(-c2ccccc2)c(=O)n2CCc3ccc(Cl)cc3-c12
SMILES: O[C@H]1CCN(C1)C(=O)c1cc(-c2ccccc2)c(=O)n2CCc3ccc(Cl)cc3-c12
InChI key: ASOBQUGZPVVXJT-SFHVURJKSA-N
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