BrP-LPA

Ligand id: 6985

Name: BrP-LPA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 20
Topological polar surface area 113.87
Molecular weight 486.17
XLogP 6.67
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

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

Selectivity at human GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
LPA1 receptor Antagonist Antagonist 6.1 pKi - 1
pKi 6.1 (Ki 8.05x10-7 M) [1]
LPA1 receptor Antagonist Antagonist 5.3 pIC50 - 1
pIC50 5.3 (IC50 4.52x10-6 M) [1]
Selectivity at mouse GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
LPA2 receptor Antagonist Antagonist 6.6 pKi - 1
pKi 6.6 (Ki 2.45x10-7 M) [1]
LPA2 receptor Antagonist Antagonist 6.3 pIC50 - 1
pIC50 6.3 (IC50 4.68x10-7 M) [1]