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BDBM50329127 1,1,1-trifluoro-N-((1-(1-(2-fluorophenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-ylsulfonyl)-4-methoxypiperidin-4-yl)methyl)methanesulfonamide::CHEMBL1271296

SMILES: COC1(CNS(=O)(=O)C(F)(F)F)CCN(CC1)S(=O)(=O)c1cc2cccnc2n1S(=O)(=O)c1ccccc1F

InChI Key: InChIKey=UVISRUJRUYULLZ-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50329127   
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 2


(Homo sapiens (Human))
BDBM50329127
PNG
(1,1,1-trifluoro-N-((1-(1-(2-fluorophenylsulfonyl)-...)
Show SMILES COC1(CNS(=O)(=O)C(F)(F)F)CCN(CC1)S(=O)(=O)c1cc2cccnc2n1S(=O)(=O)c1ccccc1F
Show InChI InChI=1S/C21H22F4N4O7S3/c1-36-20(14-27-39(34,35)21(23,24)25)8-11-28(12-9-20)38(32,33)18-13-15-5-4-10-26-19(15)29(18)37(30,31)17-7-3-2-6-16(17)22/h2-7,10,13,27H,8-9,11-12,14H2,1H3
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PC cid
PC sid
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Article
PubMed
2.5n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of beta-arrestin binding to recombinant cannabinoid CB2 receptor


Bioorg Med Chem Lett 20: 6785-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.126
BindingDB Entry DOI: 10.7270/Q26Q1XGJ
More data for this
Ligand-Target Pair