BDBM50267285 CHEMBL445804::tert-butyl (6S,9R,11S,12S,15S,18S)-11-hydroxy-12-isobutyl-6-isopropyl-2,9,19-trimethyl-15-(2-(methylthio)ethyl)-5,8,14,17-tetraoxo-4,7,13,16-tetraazaicosan-18-ylcarbamate

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

InChI Key InChIKey=ZMUJLPMFGFHYOY-JVACCQEYSA-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 = 50267285   

TargetBeta-secretase 1(Homo sapiens (Human))
Purdue University

Curated by ChEMBL
LigandPNGBDBM50267285(CHEMBL445804 | tert-butyl (6S,9R,11S,12S,15S,18S)-...)
Affinity DataKi:  0.800nMAssay Description:Inhibition of recombinant memapsin 2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed