valsartan

Ligand id: 3937

Name: valsartan

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 11
Topological polar surface area 112.07
Molecular weight 435.23
XLogP 7.05
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (2012))
IUPAC Name
(2S)-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
International Nonproprietary Names
INN number INN
7016 valsartan
Synonyms
CGP-48933 | Diovan®
Database Links
CAS Registry No. 137862-53-4 (source: Scifinder)
ChEBI CHEBI:9927
ChEMBL Ligand CHEMBL1069
DrugBank Ligand DB00177
PubChem CID 60846
Search Google for chemical match using the InChIKey ACWBQPMHZXGDFX-QFIPXVFZSA-N
Search Google for chemicals with the same backbone ACWBQPMHZXGDFX
Search PubMed clinical trials valsartan
Search PubMed titles valsartan
Search PubMed titles/abstracts valsartan
Search UniChem for chemical match using the InChIKey ACWBQPMHZXGDFX-QFIPXVFZSA-N
Search UniChem for chemicals with the same backbone ACWBQPMHZXGDFX
Wikipedia Valsartan
Comments
Valsartan is an antagonist with high affinity for the type I (AT1) angiotensin receptor.