HSD17B13-IN-26
HIT218848211
sdf文件结构编辑类似物检索
HIT ID: HIT218848211
Cas No: 2919797-61-6
分子式: C22H25F5N6O3S
分子量: 548.53
常用名: HSD17B13-IN-26
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2,6-difluoro-3-{6-[4-methanesulfonyl-2-(2-methylpropyl)piperazin-1-yl]-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-5-(trifluoromethyl)phenol
IUPAC: 2,6-difluoro-3-{6-[4-methanesulfonyl-2-(2-methylpropyl)piperazin-1-yl]-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-5-(trifluoromethyl)phenol
SMILES: CC(C)CC1CN(CCN1c1ncc2c(nn(C)c2n1)-c1cc(c(F)c(O)c1F)C(F)(F)F)S(C)(=O)=O
SMILES: CC(C)CC1CN(CCN1c1ncc2c(nn(C)c2n1)-c1cc(c(F)c(O)c1F)C(F)(F)F)S(C)(=O)=O
InChI key: CIFWAMHTHSDRET-UHFFFAOYSA-N
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