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BDBM50161563 4,5-Bis-(2,4-dichloro-phenyl)-1-methyl-1H-imidazole-2-carboxylic acid piperidin-1-ylamide::CHEMBL180144

SMILES: Cn1c(nc(c1-c1ccc(Cl)cc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1

InChI Key: InChIKey=MLLKJQJPAAWFLN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50161563   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50161563
PNG
(4,5-Bis-(2,4-dichloro-phenyl)-1-methyl-1H-imidazol...)
Show SMILES Cn1c(nc(c1-c1ccc(Cl)cc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1 |(-3.44,1.69,;-2.24,1.11,;-.74,2.18,;.52,1.3,;.1,-.17,;-1.46,-.22,;-2.21,-1.57,;-1.39,-2.88,;-2.14,-4.23,;-3.7,-4.25,;-4.45,-5.6,;-4.48,-2.95,;-3.72,-1.59,;-4.52,-.29,;.89,-1.5,;.15,-2.83,;.94,-4.16,;2.5,-4.14,;3.3,-5.44,;3.24,-2.76,;2.43,-1.45,;3.17,-.1,;-.79,3.72,;-2.14,4.47,;.56,4.54,;1.9,3.82,;1.9,5.33,;3.2,6.1,;4.56,5.33,;4.56,3.79,;3.23,3.05,)|
Show InChI InChI=1S/C22H20Cl4N4O/c1-29-20(16-8-6-14(24)12-18(16)26)19(15-7-5-13(23)11-17(15)25)27-21(29)22(31)28-30-9-3-2-4-10-30/h5-8,11-12H,2-4,9-10H2,1H3,(H,28,31)
PDB

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Similars

Article
PubMed
n/an/a 16n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against human recombinant cannabinoid receptor type 1 expressed in Chinese Hamster Ovary (CHO) cells


Bioorg Med Chem Lett 15: 1441-6 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.078
BindingDB Entry DOI: 10.7270/Q2F18Z7R
More data for this
Ligand-Target Pair