BDBM50253156 CHEMBL492179::Isosorbide-2-(methylcarbamate)-5-mononitrate

SMILES CNC(=O)O[C@H]1CO[C@@H]2[C@@H](CO[C@H]12)O[N+]([O-])=O

InChI Key InChIKey=DEDWFQACIHPQHF-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50253156   

TargetCholinesterase(Human)
Trinity College

Curated by ChEMBL
LigandPNGBDBM50253156(Isosorbide-2-(methylcarbamate)-5-mononitrate | CHE...)
Affinity DataIC50: 5.10E+3nMAssay Description:Inhibition of human plasma BuchE by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetAcetylcholinesterase(Electric eel)
Trinity College

Curated by ChEMBL
LigandPNGBDBM50253156(Isosorbide-2-(methylcarbamate)-5-mononitrate | CHE...)
Affinity DataIC50: 1.72E+4nMAssay Description:Inhibition of electric eel AchE by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed