BDBM487 (Hydroxyethyl)urea Isostere deriv. 15::benzyl N-[(1S)-1-{[(2S,3R)-4-[(tert-butylcarbamoyl)(cyclohexylmethyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamoyl}-2-carbamoylethyl]carbamate

SMILES CC(C)(C)NC(=O)N(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)OCc1ccccc1)CC1CCCCC1

InChI Key InChIKey=IJBPAVCQGVFAKL-UHFFFAOYSA-N

Data  1 IC50

  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 = 487   

TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Monsanto Corporate Research

LigandPNGBDBM487(benzyl N-[(1S)-1-{[(2S,3R)-4-[(tert-butylcarbamoyl...)
Affinity DataIC50: 29nMpH: 6.4 T: 2°CAssay Description:IC50 values for inhibition of recombinant HIV protease were determined using the spectrofluorometric assay, which utilized an intramolecularly quench...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/7/2004
Entry Details Article
PubMed