BDBM50212175 2-[(5R,14R)-5-amino-10-fluoro-14-(4-fluoro-phenyl)-5-methyl-4,16-dioxo-3-oxa-15-aza-tricyclo[15.3.1.1*7,11*]docosa-1(21),7,9,11(22),17,19-hexaen-19-yl]-6-fluoro-benzonitrile::CHEMBL399425

SMILES C[C@@]1(N)Cc2ccc(F)c(CC[C@@H](NC(=O)c3cc(COC1=O)cc(c3)-c1cccc(F)c1C#N)c1ccc(F)cc1)c2

InChI Key InChIKey=BXHPSYQIHJUXBU-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50212175   

TargetBeta-secretase 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50212175(2-[(5R,14R)-5-amino-10-fluoro-14-(4-fluoro-phenyl)...)
Affinity DataIC50: 46nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed