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SMILES: [O-][N+](=O)c1cc(I)cc(c1)C#Cc1ccccn1

InChI Key: InChIKey=VTDYPODSGWFGAA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50345575   
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


(Rattus norvegicus (Rat))		BDBM50345575
PNG
(3-(2-(pyridin-2-yl)ethynyl)-5-iodonitrobenzene | C...)
Show SMILES [O-][N+](=O)c1cc(I)cc(c1)C#Cc1ccccn1
Show InChI InChI=1S/C13H7IN2O2/c14-11-7-10(8-13(9-11)16(17)18)4-5-12-3-1-2-6-15-12/h1-3,6-9H
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.09n/an/an/an/an/an/a



Institute for Neurodegenerative Disorders

Curated by ChEMBL


Assay Description
Antagonist activity at rat mGluR5 expressed in human HEK-293 cells assessed as inhibition of glutamate-induced intracellular calcium mobilization

Bioorg Med Chem Lett 21: 3243-7 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.047
BindingDB Entry DOI: 10.7270/Q290244M
More data for this
Ligand-Target Pair