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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50309058'   
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
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50309058
PNG
(CHEMBL592471 | cis-1,6-bis(4-chlorophenyl)-3-(3,4-...)
Show SMILES Fc1ccc(C[C@@H]2CC[C@@H](N(C2=O)c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1F |r|
Show InChI InChI=1S/C24H19Cl2F2NO/c25-18-5-2-16(3-6-18)23-12-4-17(13-15-1-11-21(27)22(28)14-15)24(30)29(23)20-9-7-19(26)8-10-20/h1-3,5-11,14,17,23H,4,12-13H2/t17-,23+/m0/s1
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Similars

Article
PubMed
>1.78E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human CB2 receptor


Bioorg Med Chem Lett 20: 1278-83 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.075
BindingDB Entry DOI: 10.7270/Q2B27W7Z
More data for this
Ligand-Target Pair