cyclothiazide

Ligand id: 4167

Name: cyclothiazide

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 135.12
Molecular weight 389.03
XLogP 0.8
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
We have been unable to find peer reviewed affinity data to quantify the interaction between this drug and any of its proposed human molecular targets.
Selectivity at human ion channels
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
GluA2 Allosteric modulator Positive 5.7 pEC50 - 2
pEC50 5.7 (EC50 2.24x10-6 M) [2]
GluA4 Allosteric modulator Positive 5.4 pEC50 - 2
pEC50 5.4 (EC50 3.91x10-6 M) [2]
GluA3 Allosteric modulator Positive 4.9 pEC50 - 2
pEC50 4.9 (EC50 1.37x10-5 M) [2]
GluA1 Allosteric modulator Positive 4.7 pEC50 - 2
pEC50 4.7 (EC50 1.9x10-5 M) [2]
Selectivity at human transporters
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Target Type Action Affinity Units Concentration range (M) Reference
Na-Cl symporter Inhibitor Inhibition - - -
Targets where the ligand is described in the comment field
Target Comment
Ligand mentioned in the following text fields