valproic acid

Ligand id: 7009

Name: valproic acid

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 37.3
Molecular weight 144.12
XLogP 2.74
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1978))
IUPAC Name
2-propylpentanoic acid
International Nonproprietary Names
INN number INN
3300 valproic acid
Synonyms
A-44090 | Depakote® | Epilim® | valproate sodium
Database Links
CAS Registry No. 99-66-1
ChEMBL Ligand CHEMBL109
DrugBank Ligand DB00313
GtoPdb PubChem SID 178103588
PubChem CID 3121
RCSB PDB Ligand 2PP
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Wikipedia Valproic_acid
Comments
Valproic acid is a fatty acid with anticonvulsant properties. It is commonly administered in a salt preparation, valproate sodium.