BDBM15803 (2R,4S)-4-[(2S,5S,12S)-12-amino-2-methyl-3,13-dioxo-1,4-diazacyclotridecan-5-yl]-N-[(1S)-1-(benzylcarbamoyl)-2-methylpropyl]-4-hydroxy-2-methylbutanamide::Macrocyclic BACE inhibitor 5

SMILES CC(C)[C@H](NC(=O)[C@H](C)C[C@H](O)[C@@H]1CCCCCC[C@H](N)C(=O)N[C@@H](C)C(=O)N1)C(=O)NCc1ccccc1

InChI Key InChIKey=RPFGAQYAKUEJHQ-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 = 15803   

TargetBeta-secretase 1(Human)
Eli Lilly

LigandPNGBDBM15803((2R,4S)-4-[(2S,5S,12S)-12-amino-2-methyl-3,13-diox...)
Affinity DataIC50: 2.40E+3nMpH: 4.6 T: 2°CAssay Description:The substrate is linked to a fluorescent dye on one end and to a quenching group on its other end. The fluorescence of the substrate is significantly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/14/2007
Entry Details Article
PubMed