LGK974 (CHEBI:78030)

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ChEBI Name	LGK974

ChEBI ID	CHEBI:78030

Definition	A carboxamide, the structure of which is that of acetamide substituted on carbon by a 2',3-dimethyl-2,4'-bipyridin-5-yl group and on nitrogen by a 5-(pyrazin-2-yl)pyridin-2-yl group. It is a highly potent, selective and orally bioavailable Porcupine inhibitor (a Wnt signalling inhibitor).

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C23H20N6O

Net Charge

Average Mass

396.44450

Monoisotopic Mass

396.16986

InChI

InChI=1S/C23H20N6O/c1-15-9-17(12-28-23(15)18-5-6-25-16(2)10-18)11-22(30)29-21-4-3-19(13-27-21)20-14-24-7-8-26-20/h3-10,12-14H,11H2,1-2H3,(H,27,29,30)

InChIKey

XXYGTCZJJLTAGH-UHFFFAOYSA-N

SMILES

Cc1cc(ccn1)-c1ncc(CC(=O)Nc2ccc(cn2)-c2cnccn2)cc1C

Roles Classification
Biological Role(s):	Wnt signalling inhibitor A substance that inhibits any of the Wnt signalling pathway, a group of signal transduction pathways made of proteins that pass signals from outside of a cell through cell surface receptors to the inside of the cell.

ChEBI Ontology
Outgoing	LGK974 (CHEBI:78030) has functional parent acetamide (CHEBI:27856) LGK974 (CHEBI:78030) has role Wnt signalling inhibitor (CHEBI:78031) LGK974 (CHEBI:78030) is a bipyridines (CHEBI:50511) LGK974 (CHEBI:78030) is a pyrazines (CHEBI:38314) LGK974 (CHEBI:78030) is a pyridines (CHEBI:26421) LGK974 (CHEBI:78030) is a secondary carboxamide (CHEBI:140325)

IUPAC Name

2-(2',3-dimethyl-2,4'-bipyridin-5-yl)-N-[5-(pyrazin-2-yl)pyridin-2-yl]acetamide

Registry Number	Type	Source
20663778	Reaxys Registry Number	Reaxys

Last Modified

07 March 2018