Name: A 65317
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214318215
Cas No:122224-84-4
常用名:A 65317
别名:A-65317, A65317
IUPAC:(2R)-2-benzyl-N-[(1S)-1-{[(1R,2S)-3-cyclohexyl-1-[(5S)-3-ethyl-2-oxo-1,3-oxazolidin-5-yl]-1-hydroxypropan-2-yl]carbamoyl}-2-(1H-imidazol-5-yl)ethyl]-N'-{2-[(2-methoxyethoxy)methoxy]ethyl}-N'-methylbutanediamide
IUPAC:(2R)-2-benzyl-N-[(1S)-1-{[(1R,2S)-3-cyclohexyl-1-[(5S)-3-ethyl-2-oxo-1,3-oxazolidin-5-yl]-1-hydroxypropan-2-yl]carbamoyl}-2-(1H-imidazol-5-yl)ethyl]-N'-{2-[(2-methoxyethoxy)methoxy]ethyl}-N'-methylbutanediamide
InChI key:JZRFAIHFMIECQR-AJISXOSTSA-N

分子式:C38H58N6O9
分子量:742.915
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]1(CN(CC)C(=O)O1)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](CC(=O)N(C)CCOCOCCOC)Cc1ccccc1
SMILES:[H][C@]1(CN(CC)C(=O)O1)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](CC(=O)N(C)CCOCOCCOC)Cc1ccccc1

A 65317 is a selective renin inhibitor that causes a blockade of the renin-angiotensin system.

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