Brief Information of the Compound and Protein
Compound Name
 Compound Info 
N-[3-[(1S,3S,6S)-5-Amino-3-methyl-4-azabicyclo[4.1.0]hept-4-en-3-yl]-4-fluoro-phenyl]-5-chloro-pyridine-2-carboxamide
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 PubChem ID
CID: 71571523
Canonical SMILES
C[C@@]1(c2cc(NC(=O)c3ccc(Cl)cn3)ccc2F)C[C@@H]2C[C@@H]2C(N)=N1
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Compound Formula C19H18ClFN4O
Compound Structure
Protein Name
 Protein Info 
Beta-secretase 1
Protein Classification
Enzyme
>
Protease
>
Aspartic protease
>
Aspartic protease AA clan
>
Aspartic protease A1A subfamily
Uniprot ID
P56817
Gene Name
BACE1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 31 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 96 nM