quinaprilat

Ligand id: 6352

Name: quinaprilat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 9
Topological polar surface area 106.94
Molecular weight 410.18
XLogP 5.64
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1991))
Prodrug quinapril
IUPAC Name
(3S)-2-[(2S)-2-[[(2S)-1-hydroxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
International Nonproprietary Names
INN number INN
6356 quinaprilat
Synonyms
CL-928
Database Links
CAS Registry No. 82768-85-2 (source: PubChem)
ChEMBL Ligand CHEMBL1733
GtoPdb PubChem SID 178102970
PubChem CID 107994
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Wikipedia Quinaprilat
Comments
The drug resulting from the metabolism of the pro-drug quinapril