α3IA

Ligand id: 4094

Name: α3IA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 68.73
Molecular weight 350.13
XLogP 3.01
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
methyl 5-(4-methoxyphenyl)-1-methyl-2-oxo-6-(pyridin-4-yl)-1,2-dihydropyridine-3-carboxylate
Database Links
ChEMBL Ligand CHEMBL413325
PubChem CID 11824289
Search Google for chemical match using the InChIKey LENMNEQXCQXJHV-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LENMNEQXCQXJHV
Search UniChem for chemical match using the InChIKey LENMNEQXCQXJHV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone LENMNEQXCQXJHV