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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 = 'BDBM21314'   
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))
BDBM21314
PNG
(4-(2-{5-methoxy-3-[(2,2,3,3-tetramethylcyclopropyl...)
Show SMILES COc1ccc2n(CCN3CCOCC3)cc(C(=O)C3C(C)(C)C3(C)C)c2c1
Show InChI InChI=1S/C23H32N2O3/c1-22(2)21(23(22,3)4)20(26)18-15-25(9-8-24-10-12-28-13-11-24)19-7-6-16(27-5)14-17(18)19/h6-7,14-15,21H,8-13H2,1-5H3
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Similars

Article
PubMed
>3.50E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories



Assay Description
IC50 values for test compounds were determined from nonlinear regression analysis of data collected from ligand binding experiments. The inhibition c...


J Med Chem 51: 1904-12 (2008)


Article DOI: 10.1021/jm7011613
BindingDB Entry DOI: 10.7270/Q2C827K2
More data for this
Ligand-Target Pair