Name: BRD9 Degrader-2
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218850382
Cas No:3033018-68-4
常用名:BRD9 Degrader-2
IUPAC:2-{5-[(4-{[2,6-dimethoxy-4-(1,4,5-trimethyl-6-oxo-1,6-dihydropyridin-3-yl)phenyl]methyl}piperazin-1-yl)methyl]-1-methyl-1,2,3,4-tetrahydroisoquinoline-2-carbonyl}-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]prop-2-enenitrile
IUPAC:2-{5-[(4-{[2,6-dimethoxy-4-(1,4,5-trimethyl-6-oxo-1,6-dihydropyridin-3-yl)phenyl]methyl}piperazin-1-yl)methyl]-1-methyl-1,2,3,4-tetrahydroisoquinoline-2-carbonyl}-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]prop-2-enenitrile
InChI key:LGLQCBGPDQBRIS-UHFFFAOYSA-N

分子式:C40H43F3N6O4S
分子量:760.88
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COc1cc(cc(OC)c1CN1CCN(Cc2cccc3C(C)N(CCc23)C(=O)C(=Cc2nc(cs2)C(F)(F)F)C#N)CC1)-c1cn(C)c(=O)c(C)c1C
SMILES:COc1cc(cc(OC)c1CN1CCN(Cc2cccc3C(C)N(CCc23)C(=O)C(=Cc2nc(cs2)C(F)(F)F)C#N)CC1)-c1cn(C)c(=O)c(C)c1C

BRD9 Degrader-2 (Compound B11)，作为一种效能显著的BRD9降解剂（DC50≤1.25nM; Dmax≥75%），主要应用于癌症研究领域。

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