BDBM17844 (Hydroxyethyl)hydrazine Isostere-Based Compound, 35::methyl N-[(1S)-1-{[(2S,3S)-3-hydroxy-4-[N'-(2-methylpropyl)[(5S)-2-oxo-3-phenyl-1,3-oxazolidin-5-yl]formohydrazido]-1-phenylbutan-2-yl]carbamoyl}-2,2-dimethylpropyl]carbamate

SMILES COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(CC(C)C)NC(=O)[C@@H]1CN(C(=O)O1)c1ccccc1)C(C)(C)C

InChI Key InChIKey=KLUPNGHJEAUIGT-YIPNQBBMSA-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 = 17844   

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

LigandPNGBDBM17844((Hydroxyethyl)hydrazine Isostere-Based Compound, 3...)
Affinity DataKi:  10.6nM ΔG°:  -11.1kcal/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