Name: NLRP3-IN-66
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT219200861
Cas No:3052155-88-8
常用名:NLRP3-IN-66
IUPAC:2-(4'-{[(3R,5R)-5-fluoro-1-methylpiperidin-3-yl]amino}-5',8'-dihydrospiro[cyclopropane-1,7'-pyrano[3,4-d]pyridazin]-1'-yl)-5-(trifluoromethyl)phenol
IUPAC:2-(4'-{[(3R,5R)-5-fluoro-1-methylpiperidin-3-yl]amino}-5',8'-dihydrospiro[cyclopropane-1,7'-pyrano[3,4-d]pyridazin]-1'-yl)-5-(trifluoromethyl)phenol
InChI key:JJXNMFFKTMMOHQ-ZIAGYGMSSA-N

分子式:C22H24F4N4O2
分子量:452.454
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CN1C[C@H](F)C[C@H](C1)Nc1nnc(c2CC3(CC3)OCc12)-c1ccc(cc1O)C(F)(F)F
SMILES:CN1C[C@H](F)C[C@H](C1)Nc1nnc(c2CC3(CC3)OCc12)-c1ccc(cc1O)C(F)(F)F

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