Ligand id: 6849

Name: topiramate

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 123.92
Molecular weight 339.1
XLogP -1.2
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

Bioactivity Comments
Due to the polypharmacology of this drug we have not mapped it to a primary target.
Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
carbonic anhydrase 7 Hs Inhibitor Inhibition 9.1 pKi - 4
pKi 9.1 (Ki 9x10-10 M) [4]
carbonic anhydrase 12 Hs Inhibitor Inhibition 8.4 pKi - 5
pKi 8.4 (Ki 3.8x10-9 M) [5]
carbonic anhydrase 4 Hs Inhibitor Inhibition 7.4 pKi - 2
pKi 7.4 (Ki 4.3x10-8 M) [2]
carbonic anhydrase 1 Hs Inhibitor Inhibition 6.6 pKi - 5
pKi 6.6 (Ki 2.5x10-7 M) [5]