PH-797804

Ligand id: 7818

Name: PH-797804

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 58.64
Molecular weight 476.05
XLogP 5.17
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxopyridin-1-yl]-N,4-dimethylbenzamide
Database Links
CAS Registry No. 586379-66-0
ChEMBL Ligand CHEMBL1088751
PubChem CID 22049997
RCSB PDB Ligand I45
Search Google for chemical match using the InChIKey KCAJXIDMCNPGHZ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KCAJXIDMCNPGHZ
Search UniChem for chemical match using the InChIKey KCAJXIDMCNPGHZ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KCAJXIDMCNPGHZ
SynPHARM 80641 (in complex with mitogen-activated protein kinase 14)
Comments
PH-797804 is a diarylpyridinone inhibitor of p38 mitogen-activated protein (MAP) kinase [3].