BDBM50015892 7-Acetoxy-3-acetoxymethyl-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester::CHEMBL85914

SMILES CC(=O)OCC1=C(N2[C@H](SC1)[C@@H](OC(C)=O)C2=O)C(=O)OC(C)(C)C

InChI Key InChIKey=RDSXBOPLSOTLLZ-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50015892   

TargetNeutrophil elastase(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50015892(CHEMBL85914 | 7-Acetoxy-3-acetoxymethyl-8-oxo-5-th...)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibitory concentration which is required to cause 50% inhibition of human leukocyte elastase (HLE) enzymeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed