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SMILES: CN1CCc2nc(ccc2C1=O)C#Cc1cccc(F)c1

InChI Key: InChIKey=XMNSDFJQYSFCDF-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50337959   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50337959
PNG
(2-((3-fluorophenyl)ethynyl)-6-methyl-7,8-dihydro-1...)
Show SMILES CN1CCc2nc(ccc2C1=O)C#Cc1cccc(F)c1
Show InChI InChI=1S/C17H13FN2O/c1-20-10-9-16-15(17(20)21)8-7-14(19-16)6-5-12-3-2-4-13(18)11-12/h2-4,7-8,11H,9-10H2,1H3
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Article
PubMed
n/an/a 170n/an/an/an/an/an/a



Vanderbilt Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity against mGlu5 receptor assessed as inhibition of calcium mobilization

Bioorg Med Chem Lett 21: 1350-3 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.044
BindingDB Entry DOI: 10.7270/Q24B31MX
More data for this
Ligand-Target Pair