BDBM17836 2-(2,6-dimethylphenoxy)-N-[(2S,4S,5S)-5-{[(5S)-3-(4-acetylphenyl)-2-oxo-1,3-oxazolidin-5-yl]formamido}-4-hydroxy-1,6-diphenylhexan-2-yl]acetamide::Hydroxyethylene Isostere-Based Compound, 16f

SMILES CC(=O)c1ccc(cc1)N1C[C@H](OC1=O)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C[C@H](Cc1ccccc1)NC(=O)COc1c(C)cccc1C

InChI Key InChIKey=VEJOBLYVGLPABL-ZYXDSXQBSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 17836   

TargetDimer of Gag-Pol polyprotein [491-589,Q496K](Human immunodeficiency virus type 1)
University of Massachusetts Medical School

LigandPNGBDBM17836(2-(2,6-dimethylphenoxy)-N-[(2S,4S,5S)-5-{[(5S)-3-(...)
Affinity DataKi:  39.9nM ΔG°:  -10.3kcal/molepH: 4.7 T: 2°CAssay Description:HIV-1 protease inhibitor activities were determined by the fluorescence resonance energy transfer (FRET) method. The energy transfer donor (EDANS) an...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed