Name: T863
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212038026
Cas No:701232-20-4
常用名:T863
别名:DGAT-3, DGAT-1 inhibitor
IUPAC:2-[(1r,4r)-4-(4-{4-amino-7,7-dimethyl-7H-pyrimido[4,5-b][1,4]oxazin-6-yl}phenyl)cyclohexyl]acetic acid
IUPAC:2-[(1r,4r)-4-(4-{4-amino-7,7-dimethyl-7H-pyrimido[4,5-b][1,4]oxazin-6-yl}phenyl)cyclohexyl]acetic acid
InChI key:FUIYMYNYUHVDPT-HDJSIYSDSA-N

分子式:C22H26N4O3
分子量:394.475
氢键供体数 (HBD):2
氢键受体数 (HBA):7
LogP:3.8451176
SMILES:CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 |wU:22.25,wD:19.21,c:12,(1.61,-4.26,;2.43,-2.95,;.89,-3.01,;3.76,-3.72,;5.09,-2.95,;6.43,-3.72,;7.76,-2.95,;7.76,-1.41,;6.43,-.64,;6.43,.9,;5.09,-1.41,;3.76,-.64,;2.43,-1.41,;1.09,-.64,;1.09,.9,;-.24,1.67,;-1.57,.9,;-1.57,-.64,;-.24,-1.41,;-2.91,1.67,;-2.91,3.21,;-4.24,3.98,;-5.58,3.21,;-6.91,3.98,;-8.24,3.21,;-8.24,1.67,;-9.58,3.98,;-5.58,1.67,;-4.24,.9,)|
SMILES:CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 |wU:22.25,wD:19.21,c:12,(1.61,-4.26,;2.43,-2.95,;.89,-3.01,;3.76,-3.72,;5.09,-2.95,;6.43,-3.72,;7.76,-2.95,;7.76,-1.41,;6.43,-.64,;6.43,.9,;5.09,-1.41,;3.76,-.64,;2.43,-1.41,;1.09,-.64,;1.09,.9,;-.24,1.67,;-1.57,.9,;-1.57,-.64,;-.24,-1.41,;-2.91,1.67,;-2.91,3.21,;-4.24,3.98,;-5.58,3.21,;-6.91,3.98,;-8.24,3.21,;-8.24,1.67,;-9.58,3.98,;-5.58,1.67,;-4.24,.9,)|

市场产品/服务共显示3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 ~