riluzole

Ligand id: 2326

Name: riluzole

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 76.38
Molecular weight 234.01
XLogP 2.42
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
K2P4.1 Hs Activator Positive - - 3x10-6 - 1x10-4 3
Conc range: 3x10-6 - 1x10-4 M [3]
KCa2.3 Rn Activator Agonist - - 3x10-6 - 1x10-5 4
Conc range: 3x10-6 - 1x10-5 M [4]
KCa2.3 Hs Activator Agonist 4.9 pEC50 - 8
pEC50 4.9 (EC50 1.25x10-5 M) [8]
KCa2.2 Rn Activator Agonist 4.9 pEC50 - 8
pEC50 4.9 (EC50 1.28x10-5 M) [8]
KCa2.1 Hs Activator Agonist 4.7 pEC50 - 8
pEC50 4.7 (EC50 2.1x10-5 M) [8]
Voltage: -80.0 mV
KCa3.1 Hs Activator - 5.7 pIC50 - 8
pIC50 5.7 [8]
Kv4.3 Rn Gating inhibitor - 3.9 pIC50 - 1
pIC50 3.9 [1]
K2P2.1 Hs Activator - - - -
K2P4.1 Hs Activator - - - - 3
studied at 1-100 µM [3]