Name: PROTAC BTK Degrader-10
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT219250829
Cas No:2988804-46-0
常用名:PROTAC BTK Degrader-10
IUPAC:3-tert-butyl-N-[(1R)-1-{4-[6-({5-[(2S)-4-{2-[4-(2,4-dioxo-1,3-diazinan-1-yl)phenyl]ethyl}-2-methylpiperazin-1-yl]pyridin-2-yl}amino)pyrimidin-4-yl]-2-methylphenyl}ethyl]-1,2,4-oxadiazole-5-carboxamide
IUPAC:3-tert-butyl-N-[(1R)-1-{4-[6-({5-[(2S)-4-{2-[4-(2,4-dioxo-1,3-diazinan-1-yl)phenyl]ethyl}-2-methylpiperazin-1-yl]pyridin-2-yl}amino)pyrimidin-4-yl]-2-methylphenyl}ethyl]-1,2,4-oxadiazole-5-carboxamide
InChI key:IFISVDOJTJUTBK-WUFINQPMSA-N

分子式:C42H49N11O4
分子量:771.927
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H](NC(=O)c1nc(no1)C(C)(C)C)c1ccc(cc1C)-c1cc(Nc2ccc(cn2)N2CCN(CCc3ccc(cc3)N3CCC(=O)NC3=O)C[C@@H]2C)ncn1
SMILES:C[C@@H](NC(=O)c1nc(no1)C(C)(C)C)c1ccc(cc1C)-c1cc(Nc2ccc(cn2)N2CCN(CCc3ccc(cc3)N3CCC(=O)NC3=O)C[C@@H]2C)ncn1

PROTAC BTK Degrader-10 (Example 1P) 是一种靶向BTK的PROTAC降解剂，用于慢性淋巴细胞白血病 (CLL) 的研究。(Pink: ligand for target protein; Black: linker; Blue: ligand for E3 ligase Cereblon)

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