compound 4g [PMID: 2680437]

Ligand id: 9198

Name: compound 4g [PMID: 2680437]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 73.14
Molecular weight 327.05
XLogP 3.02
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-{[1-(2-chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}-2H,3H-[1,3]oxazolo[4,5-b]pyridin-2-one
Database Links
BindingDB Ligand 189387
GtoPdb PubChem SID 340590210
PubChem CID 121486665
Search Google for chemical match using the InChIKey DVUFHXDFLFFOFE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DVUFHXDFLFFOFE
Search UniChem for chemical match using the InChIKey DVUFHXDFLFFOFE-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DVUFHXDFLFFOFE
Comments
Compound 4g is a GSK-3β inhibitor with anti-inflammatory activity [1].