Name: PROTAC IRAK3 degrade-1
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214323705
Cas No:2712600-00-3
常用名:PROTAC IRAK3 degrade-1
别名:PROTAC IRAK3 degrade-1
IUPAC:2-(2,6-dioxopiperidin-3-yl)-5-(4-{2-[1-(4-oxo-4-{4-[(1s,4s)-4-{[5-(propan-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino}cyclohexyl]piperazin-1-yl}butanoyl)piperidin-4-yl]ethyl}piperazin-1-yl)-2,3-dihydro-1H-isoindole-1,3-dione
IUPAC:2-(2,6-dioxopiperidin-3-yl)-5-(4-{2-[1-(4-oxo-4-{4-[(1s,4s)-4-{[5-(propan-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino}cyclohexyl]piperazin-1-yl}butanoyl)piperidin-4-yl]ethyl}piperazin-1-yl)-2,3-dihydro-1H-isoindole-1,3-dione
InChI key:ZUODKONSNNHSAJ-AMLBMYBGSA-N

分子式:C47H63N11O6
分子量:878.092
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)c1ccn2ncnc(N[C@H]3CC[C@H](CC3)N3CCN(CC3)C(=O)CCC(=O)N3CCC(CCN4CCN(CC4)c4ccc5C(=O)N(C6CCC(=O)NC6=O)C(=O)c5c4)CC3)c12 |wU:15.18,12.11,(-.91,-3.09,;-1.94,-1.94,;-3.45,-2.26,;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;4,-5.39,;2.67,-4.62,;6.67,-5.39,;6.67,-6.93,;8,-7.7,;9.34,-6.93,;9.34,-5.39,;8,-4.62,;10.67,-7.7,;10.67,-9.24,;12,-6.93,;13.34,-7.7,;14.67,-6.93,;14.67,-5.39,;16,-7.7,;16,-9.24,;17.34,-10.01,;18.67,-9.24,;20.01,-10.01,;21.34,-9.24,;22.67,-10.01,;22.67,-11.55,;24.01,-12.32,;25.34,-11.55,;25.34,-10.01,;24.01,-9.24,;26.67,-12.32,;26.67,-13.86,;28.01,-14.63,;29.34,-13.86,;30.81,-14.34,;31.28,-15.8,;31.71,-13.09,;33.25,-13.09,;34.02,-14.42,;35.56,-14.42,;36.33,-13.09,;37.87,-13.09,;35.56,-11.76,;34.02,-11.76,;33.25,-10.42,;30.81,-11.84,;31.28,-10.38,;29.34,-12.32,;28.01,-11.55,;18.67,-7.7,;17.34,-6.93,;)|
SMILES:CC(C)c1ccn2ncnc(N[C@H]3CC[C@H](CC3)N3CCN(CC3)C(=O)CCC(=O)N3CCC(CCN4CCN(CC4)c4ccc5C(=O)N(C6CCC(=O)NC6=O)C(=O)c5c4)CC3)c12 |wU:15.18,12.11,(-.91,-3.09,;-1.94,-1.94,;-3.45,-2.26,;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;4,-5.39,;2.67,-4.62,;6.67,-5.39,;6.67,-6.93,;8,-7.7,;9.34,-6.93,;9.34,-5.39,;8,-4.62,;10.67,-7.7,;10.67,-9.24,;12,-6.93,;13.34,-7.7,;14.67,-6.93,;14.67,-5.39,;16,-7.7,;16,-9.24,;17.34,-10.01,;18.67,-9.24,;20.01,-10.01,;21.34,-9.24,;22.67,-10.01,;22.67,-11.55,;24.01,-12.32,;25.34,-11.55,;25.34,-10.01,;24.01,-9.24,;26.67,-12.32,;26.67,-13.86,;28.01,-14.63,;29.34,-13.86,;30.81,-14.34,;31.28,-15.8,;31.71,-13.09,;33.25,-13.09,;34.02,-14.42,;35.56,-14.42,;36.33,-13.09,;37.87,-13.09,;35.56,-11.76,;34.02,-11.76,;33.25,-10.42,;30.81,-11.84,;31.28,-10.38,;29.34,-12.32,;28.01,-11.55,;18.67,-7.7,;17.34,-6.93,;)|

PROTAC IRAK3 degrade-1 is a potent and selective degrader of IRAK3 ( IC 50 = 5 nM).

市场产品/服务共显示1个结果

供应商
TargetMolSC
规格
货期
35日内发货
纯度
-
¥ 26,800.00
1

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