BDBM9222 (2S)-N-(cyclopentylmethyl)-3-[(5S)-2,5-dibenzyl-3-oxomorpholin-4-yl]-2-hydroxy-N-(4-methoxyphenyl)propane-1-sulfonamido::morpholinone scaffold 2::morpholinone scaffold B

SMILES COc1ccc(cc1)S(=O)(=O)N(C[C@@H](O)CN1[C@@H](Cc2ccccc2)COC(Cc2ccccc2)C1=O)CC1CCCC1

InChI Key InChIKey=DESRIHHDJCUSEM-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 = 9222   

TargetDimer of Gag-Pol polyprotein [501-599,Q508K,L534I,L564I,C568A,C596A](Human immunodeficiency virus type 1)
Glaxosmithkline

LigandPNGBDBM9222((2S)-N-(cyclopentylmethyl)-3-[(5S)-2,5-dibenzyl-3-...)
Affinity DataIC50: 30nMpH: 6.4 T: 2°CAssay Description:The Ki values were determined using fluorogenic substrate, 2-(aminobenzoyl)-Thr-Ile-Nle-Phe(p-NO2)-Gln-ArgNH2. A standard curve relating changes in f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/14/2006
Entry Details Article
PubMed