propanoic acid

Ligand id: 1062

Name: propanoic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 37.3
Molecular weight 74.04
XLogP 0.17
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
Propanoic acid
Synonyms
propionate
Database Links
BindingDB Ligand 50082199
CAS Registry No. 79-09-4 (source: DrugBank)
ChEBI CHEBI:30768
ChEMBL Ligand CHEMBL14021
DrugBank Ligand DB03766
PubChem CID 1032
RCSB PDB Ligand PPI
Search Google for chemical match using the InChIKey XBDQKXXYIPTUBI-UHFFFAOYSA-N
Search Google for chemicals with the same backbone XBDQKXXYIPTUBI
Search UniChem for chemical match using the InChIKey XBDQKXXYIPTUBI-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone XBDQKXXYIPTUBI
Wikipedia Propionate