Ligand id: 5857

Name: CJ-042794

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 75.63
Molecular weight 413.08
XLogP 5.74
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

Bioactivity Comments
As RQ-15986, this compound is undergoing preclinical testing for potential anti-cancer activity [1].
Selectivity at GPCRs
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
EP4 receptor Hs Antagonist Antagonist 8.5 pKi - 2
pKi 8.5 (Ki 3.1x10-9 M) [2]