Name: ZG1077
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT220912279
Cas No:2670380-82-0
常用名:ZG1077
IUPAC:1-(2-cyclobutyl-6-methanesulfonylphenyl)-4-[(2S,5R)-2,5-dimethyl-4-(prop-2-enoyl)piperazin-1-yl]-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1H,2H-pyrido[2,3-d]pyrimidin-2-one
IUPAC:1-(2-cyclobutyl-6-methanesulfonylphenyl)-4-[(2S,5R)-2,5-dimethyl-4-(prop-2-enoyl)piperazin-1-yl]-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1H,2H-pyrido[2,3-d]pyrimidin-2-one
InChI key:InChIKey=SVGWLNVYDOKOFN-MOPGFXCFSA-N

分子式:C33H33F2N5O5S
分子量:649.71
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H]1CN([C@@H](C)CN1C(=O)C=C)c1nc(=O)n(-c2c(cccc2S(C)(=O)=O)C2CCC2)c2nc(c(F)cc12)-c1c(O)cccc1F
SMILES:C[C@@H]1CN([C@@H](C)CN1C(=O)C=C)c1nc(=O)n(-c2c(cccc2S(C)(=O)=O)C2CCC2)c2nc(c(F)cc12)-c1c(O)cccc1F

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