compound 3 [PMID: 21105727]

Ligand id: 6223

Name: compound 3 [PMID: 21105727]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 70.92
Molecular weight 308.12
XLogP 3.77
No. Lipinski's rules broken 0

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
mGlu2 receptor Allosteric modulator Negative 6.2 pKi - 1
pKi 6.2 (Ki 6x10-7 M) [1]
mGlu3 receptor Allosteric modulator Positive 5.1 pEC50 - 1
pEC50 5.1 (EC50 8.9x10-6 M) [1]
mGlu2 receptor Allosteric modulator Negative 5.8 pIC50 - 1
pIC50 5.8 (IC50 1.5x10-6 M) [1]