GI‐530159   Click here for help

GtoPdb Ligand ID: 10337

Compound class: Synthetic organic
Comment: GI‐530159 is a K2P channel activator [1].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 70.5
Molecular weight 518.14
XLogP 8.03
No. Lipinski's rules broken 1
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Canonical SMILES FC(C(C(F)(F)F)(c1ccc(cc1)Oc1ccc(cc1)N)c1ccc(cc1)Oc1ccc(cc1)N)(F)F
Isomeric SMILES FC(C(C(F)(F)F)(c1ccc(cc1)Oc1ccc(cc1)N)c1ccc(cc1)Oc1ccc(cc1)N)(F)F
InChI InChI=1S/C27H20F6N2O2/c28-26(29,30)25(27(31,32)33,17-1-9-21(10-2-17)36-23-13-5-19(34)6-14-23)18-3-11-22(12-4-18)37-24-15-7-20(35)8-16-24/h1-16H,34-35H2
Selectivity at ion channels
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
K2P2.1 Hs Activator - 6.1 – 6.1 pEC50 - 1
pEC50 6.1 (EC50 7.6x10-7 M) [1]
Description: Measuring 86Rb efflux by TREK1 induced by GI‐530159 at 70 mM potassium.
pEC50 6.1 (EC50 8.9x10-7 M) [1]
Description: Measuring GI‐530139-induced enhanced current via single hTREK1 channels measured at +60 mV in the inside‐out manual patch configuration, in a concentration–response experiment.
K2P10.1 Hs Activator - - - - 1
Description: Whole‐cell recording from tsA‐201 cells shows a 42% enhancement in hTREK2 channel current upon activation by 1 μM GI‐530139.