Name: Bestatin-amido-Me
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

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HIT ID:HIT212080489
Cas No:339186-54-8
常用名:Bestatin-amido-Me
别名:PROTAC IAP binding moiety 1
IUPAC:(2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanamido]-N,4-dimethylpentanamide
IUPAC:(2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanamido]-N,4-dimethylpentanamide
InChI key:WXXGFNCJBKSHFH-ILXRZTDVSA-N

分子式:C17H27N3O3
分子量:321.421
氢键供体数 (HBD):4
氢键受体数 (HBA):4
LogP:0.5816047
SMILES:CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1
SMILES:CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1

Bestatin-amido-Me, a derivative of Bestatin, acts as an IAP ligand and interacts with ABL inhibitor through a linker to produce SNIPER[1].

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