SKA-121   Click here for help

GtoPdb Ligand ID: 8492

Synonyms: SKA 121 | SKA121
Compound class: Synthetic organic
Comment: SKA-121 has been shown to be a KCa3.1-specific positive gating modulator suitable for further exploring the therapeutic potential of KCa3.1 activation [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 1
Rotatable bonds 0
Topological polar surface area 52.05
Molecular weight 198.08
XLogP 2.58
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Nc1nc2c(o1)c1ccccc1c(c2)C
Isomeric SMILES Nc1nc2c(o1)c1ccccc1c(c2)C
InChI InChI=1S/C12H10N2O/c1-7-6-10-11(15-12(13)14-10)9-5-3-2-4-8(7)9/h2-6H,1H3,(H2,13,14)
InChI Key JEGUERWMMMQFJV-UHFFFAOYSA-N
References
1. Coleman N, Brown BM, Oliván-Viguera A, Singh V, Olmstead MM, Valero MS, Köhler R, Wulff H. (2014)
New positive Ca2+-activated K+ channel gating modulators with selectivity for KCa3.1.
Mol Pharmacol, 86 (3): 342-57. [PMID:24958817]