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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 2' and Ligand = 'BDBM50162580'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50162580
PNG
(6,7-Dichloro-2-cyclopentyl-2-methyl-5-[5-(2H-tetra...)
Show SMILES CC1(Cc2cc(OCCCCCc3nnn[nH]3)c(Cl)c(Cl)c2C1=O)C1CCCC1
Show InChI InChI=1S/C21H26Cl2N4O2/c1-21(14-7-4-5-8-14)12-13-11-15(18(22)19(23)17(13)20(21)28)29-10-6-2-3-9-16-24-26-27-25-16/h11,14H,2-10,12H2,1H3,(H,24,25,26,27)
PDB

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PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/an/an/a 761n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against metabotropic glutamate receptor 2


Bioorg Med Chem Lett 15: 1565-71 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.077
BindingDB Entry DOI: 10.7270/Q2XW4JBK
More data for this
Ligand-Target Pair