compound 12 [PMID: 19800804]

Ligand id: 6989

Name: compound 12 [PMID: 19800804]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 83.91
Molecular weight 297.06
XLogP 4.15
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Selectivity at mouse GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
LPA3 receptor Antagonist Antagonist 5.5 pIC50 - 1
pIC50 5.5 (IC50 2.992x10-6 M) [1]