Name: NEU-730
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214318576
Cas No:1622300-88-2
常用名:NEU-730
IUPAC:(1s,4s)-4-cyano-4-[4-methoxy-3-(4-phenoxybutoxy)phenyl]cyclohexane-1-carboxylic acid
IUPAC:(1s,4s)-4-cyano-4-[4-methoxy-3-(4-phenoxybutoxy)phenyl]cyclohexane-1-carboxylic acid
InChI key:OGVVVHXXDFPPNX-FEHRVWHQSA-N

分子式:C25H29NO5
分子量:423.509
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COc1ccc(cc1OCCCCOc1ccccc1)[C@]1(CC[C@@H](CC1)C(O)=O)C#N |wU:20.21,wD:20.31,23.28,(-1.33,-10.01,;,-9.24,;,-7.7,;-1.33,-6.93,;-1.33,-5.39,;,-4.62,;1.33,-5.39,;1.33,-6.93,;2.67,-7.7,;4,-6.93,;5.33,-7.7,;6.67,-6.93,;8,-7.7,;9.34,-6.93,;10.67,-7.7,;12,-6.93,;13.34,-7.7,;13.34,-9.24,;12,-10.01,;10.67,-9.24,;,-3.08,;-1.52,-3.35,;-2.51,-2.17,;-1.98,-.72,;-.46,-.45,;.53,-1.63,;-2.97,.46,;-2.44,1.91,;-4.49,.19,;1.52,-3.35,;3.03,-3.61,)|
SMILES:COc1ccc(cc1OCCCCOc1ccccc1)[C@]1(CC[C@@H](CC1)C(O)=O)C#N |wU:20.21,wD:20.31,23.28,(-1.33,-10.01,;,-9.24,;,-7.7,;-1.33,-6.93,;-1.33,-5.39,;,-4.62,;1.33,-5.39,;1.33,-6.93,;2.67,-7.7,;4,-6.93,;5.33,-7.7,;6.67,-6.93,;8,-7.7,;9.34,-6.93,;10.67,-7.7,;12,-6.93,;13.34,-7.7,;13.34,-9.24,;12,-10.01,;10.67,-9.24,;,-3.08,;-1.52,-3.35,;-2.51,-2.17,;-1.98,-.72,;-.46,-.45,;.53,-1.63,;-2.97,.46,;-2.44,1.91,;-4.49,.19,;1.52,-3.35,;3.03,-3.61,)|

NEU-730, a novel inhibitor of TbrPDEB1, shows modest inhibition of T. brucei proliferation.

市场产品/服务共显示1个结果

您无法确定哪种化合物库最适合您的项目？或者您需要定制解决方案？Anymole随时为您提供帮助。

电话：400820-0310

合作：info@screeningcompound.com

技术支持：tech@screeningcompound.com

客服：service@screeningcompound.com

正在加载 ~