TBAJ-5307
HIT218848995
sdf文件结构编辑类似物检索
HIT ID: HIT218848995
Cas No: 2332831-92-0
分子式: C30H35BrN4O6
分子量: 627.536
常用名: TBAJ-5307
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,2S)-1-(6-bromo-2-methoxyquinolin-3-yl)-1-(2,3-dimethoxypyridin-4-yl)-2-(2,6-dimethoxypyridin-4-yl)-4-(dimethylamino)butan-2-ol
IUPAC: (1R,2S)-1-(6-bromo-2-methoxyquinolin-3-yl)-1-(2,3-dimethoxypyridin-4-yl)-2-(2,6-dimethoxypyridin-4-yl)-4-(dimethylamino)butan-2-ol
SMILES: COc1cc(cc(OC)n1)[C@](O)(CCN(C)C)[C@H](c1ccnc(OC)c1OC)c1cc2cc(Br)ccc2nc1OC
SMILES: COc1cc(cc(OC)n1)[C@](O)(CCN(C)C)[C@H](c1ccnc(OC)c1OC)c1cc2cc(Br)ccc2nc1OC
InChI key: IEDHWPCLYLYTME-PDDLMNHVSA-N
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