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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 = 'BDBM50354474'   
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))
BDBM50354474
PNG
(CHEMBL1836868)
Show SMILES CCCCCN1C(=O)C(=NNC(=O)CN(C)c2ccc([N+]([O-])=O)c3nonc23)c2ccc(OC)cc12 |w:9.9|
Show InChI InChI=1S/C23H25N7O6/c1-4-5-6-11-29-18-12-14(35-3)7-8-15(18)20(23(29)32)25-24-19(31)13-28(2)16-9-10-17(30(33)34)22-21(16)26-36-27-22/h7-10,12H,4-6,11,13H2,1-3H3,(H,24,31)
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PC cid
PC sid
UniChem
Article
PubMed
387n/an/an/an/an/an/an/an/a



University of Montana

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in CHO-K1 cells


Bioorg Med Chem Lett 21: 5859-62 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.099
BindingDB Entry DOI: 10.7270/Q2K074P5
More data for this
Ligand-Target Pair