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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 = 'BDBM50364094'   
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))
BDBM50364094
PNG
(CHEMBL1950920)
Show SMILES COC(=O)N1CCC(Cn2c(nc3cc(ccc23)S(=O)(=O)CCCC(F)(F)F)C(C)(C)C)CC1
Show InChI InChI=1S/C23H32F3N3O4S/c1-22(2,3)20-27-18-14-17(34(31,32)13-5-10-23(24,25)26)6-7-19(18)29(20)15-16-8-11-28(12-9-16)21(30)33-4/h6-7,14,16H,5,8-13,15H2,1-4H3
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Article
PubMed
n/an/an/an/a 17n/an/an/an/a



Janssen Research& Development

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor


Bioorg Med Chem Lett 22: 547-52 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.091
BindingDB Entry DOI: 10.7270/Q2JW8FBF
More data for this
Ligand-Target Pair