AFD(R)

Ligand id: 2937

Name: AFD(R)

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 13
Topological polar surface area 111.82
Molecular weight 373.2
XLogP 3.77
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
S1P5 receptor Agonist Agonist 8.0 – 9.7 pEC50 - 1-2
pEC50 8.0 – 9.7 [1-2]
S1P1 receptor Agonist Agonist 8.4 – 8.8 pEC50 - 1
pEC50 8.4 – 8.8 [1]
S1P3 receptor Agonist Agonist 7.8 – 9.4 pEC50 - 1
pEC50 7.8 – 9.4 [1]
S1P4 receptor Agonist Agonist 8.3 – 8.4 pEC50 - 1-2
pEC50 8.3 – 8.4 [1-2]