Ligand id: 2497

Name: carvacrol

Structure and Physico-chemical Properties

2D Structure
Click here for structure editor
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 20.23
Molecular weight 150.1
XLogP 3.25
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
TRPV3 Mm Activator Full agonist - - 5x10-4 2
Conc range: 5x10-4 M [2]
Voltage: -80.0 – 80.0 mV
Description: Patch clamp electrophysiology
TRPM7 Mm Channel blocker Inhibition 3.5 pIC50 - 1
pIC50 3.5 (IC50 3x10-4 M) Reversible inhibition [1]
Voltage: -100.0 – 100.0 mV
Ligand mentioned in the following text fields