BDBM50308279 CHEMBL598632::N-(2-chloro-5-(S-2-fluoroethyl)thiophenyl)-N'-(3-thiomethylphenyl)-N'-methyl guanidine

SMILES COc1cc2C\C(=C/c3ccc(CN(C)Cc4ccccc4)cc3)C(=O)c2cc1OC

InChI Key InChIKey=MXNMLTUEKPHQAW-UHFFFAOYSA-N

Data  2 IC50

  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 = 50308279   

TargetAcetylcholinesterase(Human)
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50308279(N-(2-chloro-5-(S-2-fluoroethyl)thiophenyl)-N'-(3-t...)
Affinity DataIC50: 1.14E+3nMAssay Description:Inhibition of human recombinant AChE preincubated for 20 mins before substrate addition by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2010
Entry Details Article
PubMed
TargetCholinesterase(Human)
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50308279(N-(2-chloro-5-(S-2-fluoroethyl)thiophenyl)-N'-(3-t...)
Affinity DataIC50: 1.44E+5nMAssay Description:Inhibition of human BuChE preincubated for 20 mins before substrate addition by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2010
Entry Details Article
PubMed