Name: Gcase activator 1
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212036805
Cas No:1919820-28-2
常用名:Gcase activator 1
别名:LTI-291, LTI291, LTI 291
IUPAC:5,7-dimethyl-N-[(1r,4r)-4-(pentyloxy)cyclohexyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
IUPAC:5,7-dimethyl-N-[(1r,4r)-4-(pentyloxy)cyclohexyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
InChI key:HZILSILAELSWKN-QAQDUYKDSA-N

分子式:C20H30N4O2
分子量:358.486
氢键供体数 (HBD):1
氢键受体数 (HBA):4
LogP:2.8823667
SMILES:CCCCCO[C@H]1CC[C@@H](CC1)NC(=O)c1cnn2c(C)cc(C)nc12 |wU:9.12,wD:6.5,(11.7,-1.03,;10.37,-1.8,;9.03,-1.03,;7.7,-1.8,;6.37,-1.03,;5.03,-1.8,;3.7,-1.03,;3.7,.51,;2.36,1.28,;1.03,.51,;1.03,-1.03,;2.36,-1.8,;-.3,1.28,;-1.64,.51,;-1.64,-1.03,;-2.97,1.28,;-3.13,2.81,;-4.64,3.13,;-5.41,1.8,;-6.91,1.48,;-7.94,2.62,;-7.39,.01,;-6.36,-1.13,;-6.83,-2.59,;-4.85,-.81,;-4.38,.65,)|
SMILES:CCCCCO[C@H]1CC[C@@H](CC1)NC(=O)c1cnn2c(C)cc(C)nc12 |wU:9.12,wD:6.5,(11.7,-1.03,;10.37,-1.8,;9.03,-1.03,;7.7,-1.8,;6.37,-1.03,;5.03,-1.8,;3.7,-1.03,;3.7,.51,;2.36,1.28,;1.03,.51,;1.03,-1.03,;2.36,-1.8,;-.3,1.28,;-1.64,.51,;-1.64,-1.03,;-2.97,1.28,;-3.13,2.81,;-4.64,3.13,;-5.41,1.8,;-6.91,1.48,;-7.94,2.62,;-7.39,.01,;-6.36,-1.13,;-6.83,-2.59,;-4.85,-.81,;-4.38,.65,)|

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