A-967079

Ligand id: 6280

Name: A-967079

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 32.59
Molecular weight 207.11
XLogP 3.75
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 ion channels
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
TRPA1 Gating inhibitor Inhibition 7.2 pIC50 - 1
pIC50 7.2 This compoud also acts as a gating inhibitor at the rat and mouse TRPA1. [1]
Description: Calcium imaging
Conditions: HEK-293F cells expressing TRPA1