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SMILES: N#Cc1ccc(COc2cc3CCCCn3n2)nc1

InChI Key: InChIKey=VRLYYUCAOLPBEH-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50492721   
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))
BDBM50492721
PNG
(CHEMBL2408183)
Show SMILES N#Cc1ccc(COc2cc3CCCCn3n2)nc1
Show InChI InChI=1S/C14H14N4O/c15-8-11-4-5-12(16-9-11)10-19-14-7-13-3-1-2-6-18(13)17-14/h4-5,7,9H,1-3,6,10H2
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 316n/an/an/an/an/an/a



Addex Therapeutics

Curated by ChEMBL


Assay Description
Negative allosteric modulation of rat mGluR5 receptor expressed in HEK293 cells assessed as intracellular calcium flux after 170 seconds by FLIPR ass...


Bioorg Med Chem Lett 23: 4523-7 (2013)


Article DOI: 10.1016/j.bmcl.2013.06.044
BindingDB Entry DOI: 10.7270/Q29S1V02
More data for this
Ligand-Target Pair