BDBM17830 (2S)-2-acetamido-N-[(2S,4S,5S)-4-hydroxy-5-{[(5S)-2-oxo-3-[3-(trifluoromethyl)phenyl]-1,3-oxazolidin-5-yl]formamido}-1,6-diphenylhexan-2-yl]-3-methylbutanamide::Hydroxyethylene Isostere-Based Compound, 13d

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

InChI Key InChIKey=LLSDCSYISTWPMW-QDNWXXHKSA-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 = 17830   

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

LigandPNGBDBM17830((2S)-2-acetamido-N-[(2S,4S,5S)-4-hydroxy-5-{[(5S)-...)
Affinity DataKi:  2.62nM ΔG°:  -11.9kcal/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