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BDBM50180039 CHEMBL201056::N3-(2-(benzo[1,3]dioxol-5-yl)ethyl)-4-oxo-1-pentyl-1,4-dihydroquinoline-3-carboxamide

SMILES: CCCCCn1cc(C(=O)NCCc2ccc3OCOc3c2)c(=O)c2ccccc12

InChI Key: InChIKey=UNOAGRCCRNHSLP-UHFFFAOYSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50180039   
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))
BDBM50180039
PNG
(CHEMBL201056 | N3-(2-(benzo[1,3]dioxol-5-yl)ethyl)...)
Show SMILES CCCCCn1cc(C(=O)NCCc2ccc3OCOc3c2)c(=O)c2ccccc12
Show InChI InChI=1S/C24H26N2O4/c1-2-3-6-13-26-15-19(23(27)18-7-4-5-8-20(18)26)24(28)25-12-11-17-9-10-21-22(14-17)30-16-29-21/h4-5,7-10,14-15H,2-3,6,11-13,16H2,1H3,(H,25,28)
PDB

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Similars

Article
PubMed
426n/an/an/an/an/an/an/an/a



Universit£ de Lille 2

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human CB2 receptor


J Med Chem 49: 70-9 (2006)


Article DOI: 10.1021/jm050467q
BindingDB Entry DOI: 10.7270/Q2X067VC
More data for this
Ligand-Target Pair