BDBM50305538 (S)-4-{(R)-2-[1-(3-tert-Butyl-phenyl)-2,2,2-trifluoro-ethylamino]-1-hydroxy-ethyl}-19-methoxymethyl-11-oxa-3,16-diaza-tricyclo[15.3.1.1*6,10*]docosa-1(21),6(22),7,9,17,19-hexaen-2-one::CHEMBL609295

SMILES COCc1cc2NCCCCOc3cccc(C[C@H](NC(=O)c(c1)c2)[C@H](O)CNC(c1cccc(c1)C(C)(C)C)C(F)(F)F)c3

InChI Key InChIKey=VNZSVUSLCTXQLM-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 = 50305538   

TargetBeta-secretase 1(Human)
Novartis Institutes For Biomedical Research

Curated by ChEMBL
LigandPNGBDBM50305538((S)-4-{(R)-2-[1-(3-tert-Butyl-phenyl)-2,2,2-triflu...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant BACE1 expressed in Escherichia coliMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed