Ligand id: 4148

Name: CACA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 63.32
Molecular weight 101.05
XLogP -0.58
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 rat ion channels
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Target Type Action Affinity Units Concentration range (M) Reference
GABAA receptor ρ1 subunit Agonist Agonist 4.1 pEC50 - 1
pEC50 4.1 (EC50 7.4x10-5 M) [1]