BDBM50447976 CHEMBL3115033

SMILES CN1CC[C@@H](C(=O)N2C\C(=C/c3cccc(c3)[N+]([O-])=O)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2cccc(c2)[N+]([O-])=O)[C@@]11C(=O)Nc2ccccc12

InChI Key InChIKey=VPPIZGVJYULPCI-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50447976   

TargetCholinesterase(Horse)
Universiti Sains Malaysia

Curated by ChEMBL
LigandPNGBDBM50447976(CHEMBL3115033)
Affinity DataIC50: 1.23E+4nMAssay Description:Inhibition of equine serum BChE using S-butyrylthiocholine chloride as substrate preincubated for 15 mins followed by substrate addition by Ellman's ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2014
Entry Details Article
PubMed