grapiprant

Ligand id: 5858

Name: grapiprant

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 114.36
Molecular weight 491.2
XLogP 5.92
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[2-[4-(2-ethyl-4,6-dimethylimidazo[4,5-c]pyridin-1-yl)phenyl]ethyl]-3-(4-methylphenyl)sulfonylurea
International Nonproprietary Names
INN number INN
9763 grapiprant
Synonyms
AT-001 | CJ 023423 | CJ-023423 | RQ-00000007
Database Links
CAS Registry No. 415903-37-6 (source: SciFinder)
ChEMBL Ligand CHEMBL3039498
PubChem CID 11677589
Search Google for chemical match using the InChIKey HZVLFTCYCLXTGV-UHFFFAOYSA-N
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Search PubMed clinical trials grapiprant
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Search UniChem for chemical match using the InChIKey HZVLFTCYCLXTGV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone HZVLFTCYCLXTGV
Comments
Grapiprant is a potent and selective antagonist of the prostaglandin EP4 receptor [1].