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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 = 'BDBM50325577'   
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))
BDBM50325577
PNG
(3-butyl-4-(2-fluorophenyl)-N-(2-(4-fluorophenyl)pr...)
Show SMILES CCCCC1=NN(CC1c1ccccc1F)C(=O)NC(C)(C)c1ccc(F)cc1 |t:4|
Show InChI InChI=1S/C23H27F2N3O/c1-4-5-10-21-19(18-8-6-7-9-20(18)25)15-28(27-21)22(29)26-23(2,3)16-11-13-17(24)14-12-16/h6-9,11-14,19H,4-5,10,15H2,1-3H3,(H,26,29)
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Article
PubMed
32n/an/an/an/an/an/an/an/a



Abbott Healthcare Products BV

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 4992-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.056
BindingDB Entry DOI: 10.7270/Q27S7P0N
More data for this
Ligand-Target Pair