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BDBM50310042 4-((1H-1,2,4-triazol-1-yl)methyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-((1S,2S)-2-methylcyclohexyl)-1H-pyrazole-3-carboxamide::CHEMBL598094

SMILES: C[C@H]1CCCC[C@@H]1NC(=O)c1nn(c(c1Cn1cncn1)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=XNTZIHJNBFBASY-AOMKIAJQSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50310042   
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


(Rattus norvegicus (rat))
BDBM50310042
PNG
(4-((1H-1,2,4-triazol-1-yl)methyl)-5-(4-chloropheny...)
Show SMILES C[C@H]1CCCC[C@@H]1NC(=O)c1nn(c(c1Cn1cncn1)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C26H25Cl3N6O/c1-16-4-2-3-5-22(16)32-26(36)24-20(13-34-15-30-14-31-34)25(17-6-8-18(27)9-7-17)35(33-24)23-11-10-19(28)12-21(23)29/h6-12,14-16,22H,2-5,13H2,1H3,(H,32,36)/t16-,22-/m0/s1
PDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 12.9n/an/an/an/an/an/a



Green Cross Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from CB1 receptor in Sprague-Dawley rat cerebellar membrane


Bioorg Med Chem 18: 1149-62 (2010)


Article DOI: 10.1016/j.bmc.2009.12.040
BindingDB Entry DOI: 10.7270/Q2TD9XG2
More data for this
Ligand-Target Pair