Name: PD 125967
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212713267
Cas No:128139-14-0
常用名:PD 125967
别名:PD-125967, PD125967
IUPAC:6-cyclohexyl-4-hydroxy-5-[3-(1H-imidazol-4-yl)-2-[3-(naphthalen-1-yl)-2-[(naphthalen-1-yl)methyl]propanamido]propanamido]-N-(2-methylbutyl)-2-(2-methylpropyl)hexanamide
IUPAC:6-cyclohexyl-4-hydroxy-5-[3-(1H-imidazol-4-yl)-2-[3-(naphthalen-1-yl)-2-[(naphthalen-1-yl)methyl]propanamido]propanamido]-N-(2-methylbutyl)-2-(2-methylpropyl)hexanamide
InChI key:SIGGSNKWBGJQQB-UHFFFAOYSA-N

分子式:C51H67N5O4
分子量:814.128
氢键供体数 (HBD):5
氢键受体数 (HBA):5
LogP:9.342505
SMILES:CCC(C)CNC(=O)C(CC(C)C)CC(O)C(CC1CCCCC1)NC(=O)C(Cc1c[nH]cn1)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12
SMILES:CCC(C)CNC(=O)C(CC(C)C)CC(O)C(CC1CCCCC1)NC(=O)C(Cc1c[nH]cn1)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12

PD 125967 is a renin inhibitor, which represents a group of pharmaceutical drugs used primarily to treat essential hypertension.

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