SB-657510
HIT102738886
sdf文件结构编辑类似物检索
HIT ID: HIT102738886
Cas No: 474960-44-6
分子式: C19H22BrClN2O5S
分子量: 505.81
常用名: SB-657510
氢键受体数 (HBA): 6
氢键供体数 (HBD): 1
LogP: 2.4263084
IUPAC: 2-bromo-N-(4-chloro-3-{[(3R)-1-methylpyrrolidin-3-yl]oxy}phenyl)-4,5-dimethoxybenzene-1-sulfonamide
IUPAC: 2-bromo-N-(4-chloro-3-{[(3R)-1-methylpyrrolidin-3-yl]oxy}phenyl)-4,5-dimethoxybenzene-1-sulfonamide
SMILES: COc1cc(Br)c(cc1OC)S(=O)(=O)Nc1ccc(Cl)c(O[C@@H]2CCN(C)C2)c1
SMILES: COc1cc(Br)c(cc1OC)S(=O)(=O)Nc1ccc(Cl)c(O[C@@H]2CCN(C)C2)c1
InChI key: KQCZCINJGIRLCD-CYBMUJFWSA-N
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