Ligand id: 4055

Name: AC55649

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 37.3
Molecular weight 310.19
XLogP 10.2
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at nuclear hormone receptors
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
Retinoic acid receptor-β Hs Agonist Full agonist 6.9 – 7.3 pEC50 - 1-2
pEC50 6.9 – 7.3 [1-2]
Description: Affinity for RARβ2 isoform.