Name: (-)-GSK598809
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212666647
Cas No:863680-46-0
常用名:(-)-GSK598809
别名:1S,5R-GSK598809
IUPAC:(1S,5R)-1-[2-fluoro-4-(trifluoromethyl)phenyl]-3-(3-{[4-methyl-5-(4-methyl-1,3-oxazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-3-azabicyclo[3.1.0]hexane
IUPAC:(1S,5R)-1-[2-fluoro-4-(trifluoromethyl)phenyl]-3-(3-{[4-methyl-5-(4-methyl-1,3-oxazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-3-azabicyclo[3.1.0]hexane
InChI key:ZKRWPAYTJMRKLJ-BTYIYWSLSA-N

分子式:C22H23F4N5OS
分子量:481.51
氢键供体数 (HBD):0
氢键受体数 (HBA):4
LogP:3.1831303
SMILES:[H][C@@]12C[C@@]1(CN(CCCSc1nnc(-c3ocnc3C)n1C)C2)c1ccc(cc1F)C(F)(F)F
SMILES:[H][C@@]12C[C@@]1(CN(CCCSc1nnc(-c3ocnc3C)n1C)C2)c1ccc(cc1F)C(F)(F)F

(-)-GSK598809 is an isomer of GSK598809 that is a potent and selective antagonist of dopamine D3 Receptor.

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