flufenamic acid   

GtoPdb Ligand ID: 2447

flufenamic acid is an approved drug
Compound class: Synthetic organic
Comment: A non-selective cyclooxygenase inhibitor; NSAID.
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 49.33
Molecular weight 281.07
XLogP 4.2
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F
Isomeric SMILES OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F
InChI InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)
InChI Key LPEPZBJOKDYZAD-UHFFFAOYSA-N
Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
TRPM2 Hs Channel blocker Antagonist - - 5x10-5 - 1x10-3 4,8
Conc range: 5x10-5 - 1x10-3 M [4,8]
Voltage: -60.0 – -50.0 mV
TRPP2 Hs Channel blocker - - - 5x10-4 1
Conc range: 5x10-4 M [1]
Voltage: -50.0 mV
KNa1.2 Hs Activator Agonist 8.9 pEC50 - 2-3
pEC50 8.9 (EC50 1.4x10-9 M) [2-3]
TRPA1 Rn Activator Activation 3.8 pEC50 - 5
pEC50 3.8 [5]
Voltage: -100.0 mV
Description: Two electrode voltage clamp
Conditions: Xenopus oocytes expressing rat TRPA1
TRPM4 Mm Gating inhibitor Antagonist 5.6 pIC50 - 9
pIC50 5.6 (IC50 2.8x10-6 M) [9]
Voltage: 100.0 mV
TRPM5 Hs Channel blocker - 4.6 pIC50 -
pIC50 4.6 (IC50 2.4x10-5 M)
TRPC5 Hs Channel blocker - - - -
CaCC Hs Channel blocker - - - -
Cx23 Hs Inhibitor - - - -
Cx25 Hs Inhibitor - - - -
Cx26 Hs Inhibitor - - - -
Cx30 Hs Inhibitor - - - -
Cx30.2 Hs Inhibitor - - - -
Cx30.3 Hs Inhibitor - - - -
Cx31 Hs Inhibitor - - - -
Cx31.1 Hs Inhibitor - - - -
Cx31.9 Hs Inhibitor - - - -
Cx32 Hs Inhibitor - - - -
Cx36 Hs Inhibitor - - - -
Cx37 Hs Inhibitor - - - -
Cx40 Hs Inhibitor - - - -
Cx40.1 Hs Inhibitor - - - -
Cx43 Hs Inhibitor - - - -
Cx45 Hs Inhibitor - - - -
Cx46 Hs Inhibitor - - - -
Cx47 Hs Inhibitor - - - -
Cx50 Hs Inhibitor - - - -
Cx59 Hs Inhibitor - - - -
Cx62 Hs Inhibitor - - - -
Px1 Hs Inhibitor - - - -
little block by flufenamic acid
Px2 Hs Inhibitor - - - -
little block by flufenamic acid
Px3 Hs Inhibitor - - - -
little block by flufenamic acid
Additional information and targets (data relate to human unless otherwise stated)
Description Data Reference
Ligand mentioned in the following text fields