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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50364089'   
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 1


(Homo sapiens (Human))
BDBM50364089
PNG
(CHEMBL1950836)
Show SMILES CC(C)(C)c1nc2cc(ccc2n1CC1CCNCC1)S(=O)(=O)CCCC(F)(F)F
Show InChI InChI=1S/C21H30F3N3O2S/c1-20(2,3)19-26-17-13-16(30(28,29)12-4-9-21(22,23)24)5-6-18(17)27(19)14-15-7-10-25-11-8-15/h5-6,13,15,25H,4,7-12,14H2,1-3H3
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Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Janssen Research& Development

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 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