Brief Information of the Compound and Protein
Compound Name
N-[N'-[(4-acetamido-3,5-dichlorophenyl)methyl]carbamimidoyl]-3-phenyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
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PubChem ID
CID: 24772696
SID: 49694700
Canonical SMILES
CC(=O)Nc1c(Cl)cc(CN\C(N)=N\C(=O)C2C3CC3CN2c2ccccc2)cc1Cl
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Compound Formula C22H23Cl2N5O2
Compound Structure
Protein Name
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 Homo sapiens (Human)  2
1
Ki = 100 nM
   TI
   LI
   LO
   TS
2
Ki = 360 nM
   TI
   LI
   LO
   TS