BDBM50004657 CHEMBL104681::[2-(5-Dimethylaminomethyl-furan-2-ylmethylsulfanyl)-ethyl]-(5-fluoro-2,4-dinitro-phenyl)-amine

SMILES CN(C)Cc1ccc(CSCCNc2cc(F)c(cc2[N+]([O-])=O)[N+]([O-])=O)o1

InChI Key InChIKey=LAFTTYMJFZRMQP-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50004657   

TargetAcetylcholinesterase(Homo sapiens (Human))
University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50004657(CHEMBL104681 | [2-(5-Dimethylaminomethyl-furan-2-y...)
Affinity DataIC50:  120nMAssay Description:In vitro inhibition of human acetylcholinesterase.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMuscarinic acetylcholine receptor M2(RAT)
University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50004657(CHEMBL104681 | [2-(5-Dimethylaminomethyl-furan-2-y...)
Affinity DataIC50:  7.00E+3nMAssay Description:Inhibition of [3H]-N-methylscopolamine to rat muscarinic acetylcholine receptor M2 from heart tissueMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCholinesterase(Homo sapiens (Human))
University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50004657(CHEMBL104681 | [2-(5-Dimethylaminomethyl-furan-2-y...)
Affinity DataIC50:  3.80E+3nMAssay Description:In vitro inhibition of human butryl cholinesterase.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMuscarinic acetylcholine receptor M1(Mus musculus)
University of South Carolina

Curated by ChEMBL
LigandPNGBDBM50004657(CHEMBL104681 | [2-(5-Dimethylaminomethyl-furan-2-y...)
Affinity DataIC50:  1.80E+3nMAssay Description:Inhibition of [3H]-pirenzepine binding to mouse muscarinic acetylcholine receptor M1 from cerebral cortexMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed