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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 = 'BDBM50449597'   
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))
BDBM50449597
PNG
(CHEMBL4174825)
Show SMILES Cc1ccc(OCCCCCCOc2cccc(\C=C3/N=C4SCCCN4C3=O)c2)cc1 |t:20|
Show InChI InChI=1S/C26H30N2O3S/c1-20-10-12-22(13-11-20)30-15-4-2-3-5-16-31-23-9-6-8-21(18-23)19-24-25(29)28-14-7-17-32-26(28)27-24/h6,8-13,18-19H,2-5,7,14-17H2,1H3/b24-19-
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PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from recombinant human CB2 receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting method


Eur J Med Chem 155: 381-397 (2018)


Article DOI: 10.1016/j.ejmech.2018.05.050
BindingDB Entry DOI: 10.7270/Q22F7R1X
More data for this
Ligand-Target Pair