BDBM50316866 CHEMBL1087736::N-((S)-1-((4S,5S,7R)-5-hydroxy-8-(isobutylamino)-2,7-dimethyl-8-oxooctan-4-ylamino)-1-oxo-3-phenylpropan-2-yl)-4-nitrobenzamide

SMILES CC(C)CNC(=O)[C@H](C)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(cc1)[N+]([O-])=O

InChI Key InChIKey=DJFBJFNKECFROO-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 = 50316866   

TargetBeta-secretase 1(Human)
Peking University

Curated by ChEMBL
LigandPNGBDBM50316866(N-((S)-1-((4S,5S,7R)-5-hydroxy-8-(isobutylamino)-2...)
Affinity DataIC50: 1.57E+4nMAssay Description:Inhibition of human recombinant BACE1 using fluorescent peptide substrate after 5 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/19/2010
Entry Details Article
PubMed