Name: (S)-KT109
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT212972354
Cas No:2055172-61-5
常用名:(S)-KT109
别名:(S)-KT109
IUPAC:(2S)-2-benzyl-1-(4-{[1,1'-biphenyl]-4-yl}-1H-1,2,3-triazole-1-carbonyl)piperidine
IUPAC:(2S)-2-benzyl-1-(4-{[1,1'-biphenyl]-4-yl}-1H-1,2,3-triazole-1-carbonyl)piperidine
InChI key:JKJMWHULJIOKPJ-VWLOTQADSA-N

分子式:C27H26N4O
分子量:422.532
氢键供体数 (HBD):0
氢键受体数 (HBA):3
LogP:5.933738
SMILES:O=C(N1CCCC[C@H]1Cc1ccccc1)n1cc(nn1)-c1ccc(cc1)-c1ccccc1
SMILES:O=C(N1CCCC[C@H]1Cc1ccccc1)n1cc(nn1)-c1ccc(cc1)-c1ccccc1

(S)-KT109 is the (S) isomer of the diacylglycerol lipase β (DAGLβ) inhibitor KT109 . (S)-KT109 is a less potent inhibitor of DAGLβ (IC50 = 39.81 nM), DAGLα-mediated hydrolysis of 1-stearoyl-2-arachidonoyl-sn-glycerol (IC50 = 794.3 nM), and α/β-hydrolase domain-containing protein 6 (ABHD6; IC50 = 630.9 nM) than (R)-KT109 .

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