Name: PROTAC K-Ras Degrader-5
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219136924
Cas No:3052745-16-8
常用名:PROTAC K-Ras Degrader-5
IUPAC:3-{5-[4-({4-[(1-{2-[(4-{3,8-diazabicyclo[3.2.1]octan-3-yl}-7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoropyrido[4,3-d]pyrimidin-2-yl)oxy]ethyl}piperidin-4-yl)methyl]piperidin-1-yl}methyl)piperidin-1-yl]-4-fluoro-1-oxo-2,3-dihydro-1H-isoindol-2-yl}piperidine-2,6-dione
IUPAC:3-{5-[4-({4-[(1-{2-[(4-{3,8-diazabicyclo[3.2.1]octan-3-yl}-7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoropyrido[4,3-d]pyrimidin-2-yl)oxy]ethyl}piperidin-4-yl)methyl]piperidin-1-yl}methyl)piperidin-1-yl]-4-fluoro-1-oxo-2,3-dihydro-1H-isoindol-2-yl}piperidine-2,6-dione
InChI key:VUGUNNWXJMBUFV-UHFFFAOYSA-N

分子式:C57H63F3N10O5
分子量:1025.191
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Oc1cc(-c2ncc3c(nc(OCCN4CCC(CC5CCN(CC6CCN(CC6)c6ccc7C(=O)N(Cc7c6F)C6CCC(=O)NC6=O)CC5)CC4)nc3c2F)N2CC3CCC(C2)N3)c2c(C#C)c(F)ccc2c1
SMILES:Oc1cc(-c2ncc3c(nc(OCCN4CCC(CC5CCN(CC6CCN(CC6)c6ccc7C(=O)N(Cc7c6F)C6CCC(=O)NC6=O)CC5)CC4)nc3c2F)N2CC3CCC(C2)N3)c2c(C#C)c(F)ccc2c1

Pan-KRAS degrader 4 (compound 69) 作为一种基于cereblon的PROTACKRAS降解剂，展现出抗癌效能，其DC50 值低于 100 nM。

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