BDBM50398681 CHEMBL2178148

SMILES CN1C(=O)[C@@H]2CN(c3ccccc3)C[C@]2(c2ccc(-c3ccc(F)c(C#N)c3)s2)N=C1N

InChI Key InChIKey=DWVJKKOFIHHAKC-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50398681   

TargetBeta-secretase 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50398681BDBM50398681(CHEMBL2178148)
Affinity DataKi:  90nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed