Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(S)-4-(S)-Hydroxy-2-methyl-6-phenyl-5-[(S)-2-((S)-4,4,4-trifluoro-2-hydroxy-butyrylamino)-propionylamino]-hexanoic acid {(S)-2-methyl-1-[(pyridin-4-ylmethyl)-carbamoyl]-propyl}-amide
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 PubChem ID
CID: 44318126
Canonical SMILES
CC(C)[C@H](NC(=O)[C@H](C)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](O)CC(F)(F)F)C(=O)NCc1ccncc1
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Compound Formula C31H42F3N5O6
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 = 220 nM
   TI
   LI
   LO
   TS