halothane

Ligand id: 2401

Name: halothane

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 0
Molecular weight 195.89
XLogP 3.16
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!)

Bioactivity Comments
Halothane potentiates human K2P9.1 (TASK-3) activity in vitro [4].[6].
Selectivity at human ion channels
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
K2P2.1 Activator - - - - 5
studied at 1-5 mM [5]
K2P3.1 Activator - - - -
studied at 1-10 mM
K2P9.1 Activator - - - - 6
studied at 1-5 mM [6]
K2P10.1 Activator - - - - 3
studied at 1-5 mM [3]
K2P13.1 Inhibitor - - - - 1
studied at ~5 mM [1]
Selectivity at unknown species ion channels
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
Kir3.2 Gating inhibitor Antagonist 4.2 pIC50 - 7
pIC50 4.2 [7]
Voltage: -70.0 mV
Selectivity at rat ion channels
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
Kv2.1 Channel blocker - 3.5 pEC50 - 2
pEC50 3.5 [2]
Ligand mentioned in the following text fields