compound 26 [PMID: 16190743]

Ligand id: 2929

Name: compound 26 [PMID: 16190743]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 79.46
Molecular weight 391.19
XLogP 6.22
No. Lipinski's rules broken 1

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
S1P1 receptor Agonist Agonist 9.2 pIC50 - 1
pIC50 9.2 [1]
S1P5 receptor Agonist Agonist 9.0 pIC50 - 1
pIC50 9.0 [1]
S1P4 receptor Agonist Agonist 7.2 pIC50 - 1
pIC50 7.2 [1]
S1P3 receptor Agonist Agonist 4.9 pIC50 - 1
pIC50 4.9 [1]