LY339434   Click here for help

GtoPdb Ligand ID: 4246

Synonyms: LY 339434 | LY-339434
Compound class: Synthetic organic
Comment: LY339434 is a potent and selective agonist of the kainate receptor GluK1 (a.k.a. GluR5) [1-2].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 7
Topological polar surface area 100.62
Molecular weight 313.13
XLogP 0.68
No. Lipinski's rules broken 0
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Canonical SMILES OC(=O)C(CC(C(=O)O)N)CC=Cc1ccc2c(c1)cccc2
Isomeric SMILES OC(=O)C(CC(C(=O)O)N)C/C=C/c1ccc2c(c1)cccc2
InChI InChI=1S/C18H19NO4/c19-16(18(22)23)11-15(17(20)21)7-3-4-12-8-9-13-5-1-2-6-14(13)10-12/h1-6,8-10,15-16H,7,11,19H2,(H,20,21)(H,22,23)/b4-3+
Selectivity at ion channels
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
GluK1 Primary target of this compound Hs Agonist Agonist 7.8 – 7.9 pKi - 2
pKi 7.8 – 7.9 (Ki 1.5x10-8 – 1.3x10-8 M) [2]
GluK2 Hs Agonist Agonist 4.8 – 4.9 pKi - 2
pKi 4.8 – 4.9 (Ki 1.541x10-5 – 1.204x10-5 M) [2]
Ligand mentioned in the following text fields