Name: SHP2 protein degrader-2
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT219469197
Cas No:2740582-16-3
常用名:SHP2 protein degrader-2
IUPAC:(2R,4S)-1-[(2R)-2-[9-(4-{3-[(3-{[3-amino-5-(4-amino-4-methylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-2-chlorophenyl)carbamoyl]propanoyl}piperazin-1-yl)nonanamido]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1R)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
IUPAC:(2R,4S)-1-[(2R)-2-[9-(4-{3-[(3-{[3-amino-5-(4-amino-4-methylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-2-chlorophenyl)carbamoyl]propanoyl}piperazin-1-yl)nonanamido]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1R)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
InChI key:XJSPAQRZSJUBLB-ISSNAGQGSA-N

分子式:C56H79ClN12O6S2
分子量:1115.9
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H](NC(=O)[C@H]1C[C@H](O)CN1C(=O)[C@H](NC(=O)CCCCCCCCN1CCN(CC1)C(=O)CCC(=O)Nc1cccc(Sc2ncc(nc2N)N2CCC(C)(N)CC2)c1Cl)C(C)(C)C)c1ccc(cc1)-c1scnc1C
SMILES:C[C@@H](NC(=O)[C@H]1C[C@H](O)CN1C(=O)[C@H](NC(=O)CCCCCCCCN1CCN(CC1)C(=O)CCC(=O)Nc1cccc(Sc2ncc(nc2N)N2CCC(C)(N)CC2)c1Cl)C(C)(C)C)c1ccc(cc1)-c1scnc1C

SHP2protein degrader-2 (SHP2-D26) 是一种SHP2蛋白PROTAC 降解剂。SHP2protein degrader-2 可降低各种癌细胞中SHP2的表达水平。

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