enalaprilat

Ligand id: 6332

Name: enalaprilat

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 348.17
XLogP 3.4
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1985))
Prodrug enalapril
IUPAC Name
(2S)-1-[(2S)-2-[[(2S)-1-hydroxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid
International Nonproprietary Names
INN number INN
5424 enalaprilat
Synonyms
MK-422
Database Links
ChEBI CHEBI:4786
ChEMBL Ligand CHEMBL577
GtoPdb PubChem SID 178102950
PubChem CID 5462501
RCSB PDB Ligand EAL
Search Google for chemical match using the InChIKey LZFZMUMEGBBDTC-QEJZJMRPSA-N
Search Google for chemicals with the same backbone LZFZMUMEGBBDTC
Search PubMed clinical trials enalaprilat
Search PubMed titles enalaprilat
Search PubMed titles/abstracts enalaprilat
Search UniChem for chemical match using the InChIKey LZFZMUMEGBBDTC-QEJZJMRPSA-N
Search UniChem for chemicals with the same backbone LZFZMUMEGBBDTC
SynPHARM 78474 (in complex with Angiotensin-converting enzyme)
Wikipedia Enalaprilat
Comments
Active metabolite of enalapril prodrug. There are 15 stereo forms in PubChem. Enalaprilat is known as an ACE inhibitor.