3-pyridine-acetic acid

Ligand id: 1590

Name: 3-pyridine-acetic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 50.19
Molecular weight 137.05
XLogP 0.63
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
2-pyridin-3-ylacetic acid
Synonyms
3-pyridineacetic acid
Database Links
CAS Registry No. 501-81-5 (source: SciFinder)
ChEMBL Ligand CHEMBL1741437
PubChem CID 108
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Search Google for chemicals with the same backbone WGNUNYPERJMVRM
Search UniChem for chemical match using the InChIKey WGNUNYPERJMVRM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WGNUNYPERJMVRM