Name: SW IV-52
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212710608
Cas No:845745-37-1
常用名:SW IV-52
别名:SW-IV-52, SWIV52, SW IV52, SW IV 52
IUPAC:(2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide hydrochloride
IUPAC:(2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide hydrochloride
InChI key:CMFDULVBZVNDFI-RKVNAYBESA-N

分子式:C25H39ClN4O3
分子量:479.06
氢键供体数 (HBD):3
氢键受体数 (HBA):4
LogP:2.4489923
SMILES:Cl.CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C
SMILES:Cl.CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C

SW IV-52 is an XIAP-inhibitor that acts as a second mitochondria-derived activator of caspases (SMAC) mimetic.

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