BDBM50081674 2-Ethyl-3-(3-fluoro-propylsulfanylcarbonyl)-1-methyl-6-phenyl-5-propoxycarbonyl-4-propyl-pyridinium; iodide::CHEMBL424079

SMILES CCCOC(=O)c1c(CCC)c(C(=O)SCCCF)c(CC)[n+](C)c1-c1ccccc1

InChI Key InChIKey=VXXYHVKUGOONJN-UHFFFAOYSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50081674   

TargetAdenosine receptor A3(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50081674(2-Ethyl-3-(3-fluoro-propylsulfanylcarbonyl)-1-meth...)
Affinity DataKi:  465nMAssay Description:Displacement of [3H]AB-MECA from human Adenosine A3 receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50081674(2-Ethyl-3-(3-fluoro-propylsulfanylcarbonyl)-1-meth...)
Affinity DataKi:  7.37E+3nMAssay Description:Displacement of [3H]CGS-21680 from Adenosine A2A receptor of rat striatal membranes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed