GSK579289A
HIT212712770
sdf文件结构编辑类似物检索
HIT ID: HIT212712770
Cas No: 929095-23-8
分子式: C26H27ClN4O3S
分子量: 511.04
常用名: GSK579289A
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 4.5272126
IUPAC: 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-{6-[(1-methylpiperidin-4-yl)oxy]-1H-1,3-benzodiazol-1-yl}thiophene-2-carboxamide
IUPAC: 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-{6-[(1-methylpiperidin-4-yl)oxy]-1H-1,3-benzodiazol-1-yl}thiophene-2-carboxamide
SMILES: C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(OC3CCN(C)CC3)cc12)c1ccccc1Cl
SMILES: C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(OC3CCN(C)CC3)cc12)c1ccccc1Cl
InChI key: GILNGUYOGYOZMP-MRXNPFEDSA-N
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