BDBM17839 2-(2,6-dimethylphenoxy)-N-[(2S,3S,5S)-3-hydroxy-5-{[(5S)-2-oxo-3-[3-(trifluoromethyl)phenyl]-1,3-oxazolidin-5-yl]formamido}-1,6-diphenylhexan-2-yl]acetamide::Hydroxyethylene Isostere-Based Compound, 22d

SMILES Cc1cccc(C)c1OCC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1CN(C(=O)O1)c1cccc(c1)C(F)(F)F

InChI Key InChIKey=BFHBZKMCMTWBSI-DYTOPAQESA-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 = 17839   

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

LigandPNGBDBM17839(2-(2,6-dimethylphenoxy)-N-[(2S,3S,5S)-3-hydroxy-5-...)
Affinity DataKi:  21.6nM ΔG°:  -10.6kcal/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