BDBM50114912 (2S,4R)-4-Mercapto-2-(5-methylsulfanyl-4-phenyl-4H-[1,2,4]triazol-3-yl)-pyrrolidine-1-carboxylic acid butyl ester::CHEMBL49451

SMILES CCCCOC(=O)N1C[C@H](S)C[C@H]1c1nnc(SC)n1-c1ccccc1

InChI Key InChIKey=VWGXTFDVAOABAS-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 = 50114912   

TargetEndothelin-converting enzyme 1(Human)
F. Hoffmann-La Roche

Curated by ChEMBL
LigandPNGBDBM50114912((2S,4R)-4-Mercapto-2-(5-methylsulfanyl-4-phenyl-4H...)
Affinity DataIC50: 2.70E+3nMAssay Description:Tested for inhibitory concentration against human Endothelin-converting enzyme 1 at 10 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed