BDBM50156005 CHEMBL189358::[(S)-1-({[(S)-4-((S)-1-Benzylcarbamoyl-2-methyl-propylcarbamoyl)-2-hydroxy-1-isobutyl-pentylcarbamoyl]-carbamoyl-methyl}-carbamoyl)-2-methyl-propyl]-carbamic acid tert-butyl ester

SMILES CC(C)C[C@H](NC(=O)C(NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(N)=O)C(O)CC(C)C(=O)N[C@@H](C(C)C)C(=O)NCc1ccccc1

InChI Key InChIKey=SOFGRHVPYISOLD-CRYDEKTISA-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 = 50156005   

TargetBeta-secretase 1(Homo sapiens (Human))
University Of ZüRich

Curated by ChEMBL
LigandPNGBDBM50156005(CHEMBL189358 | [(S)-1-({[(S)-4-((S)-1-Benzylcarbam...)
Affinity DataKi:  5.90nMAssay Description:Binding affinity towards Beta-secretase determined using continuum electrostatics solvationMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed