BDBM9263 2-(but-3-en-1-yloxy)-3-hydroxy-N-[(2R,3S)-2-hydroxy-1-[(4-methoxybenzene)(2-methylpropyl)sulfonamido]non-8-en-3-yl]benzamide::2-(but-3-enyloxy)-3-hydroxy-N-[(1S)-1-((1R)-1-hydroxy-2-{isobutyl[(4-methoxyphenyl)sulfonyl]amino}ethyl)hept-6-enyl]benzamide::acyclic inhibitor 20

SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](CCCCC=C)NC(=O)c1cccc(O)c1OCCC=C

InChI Key InChIKey=JNRAGFTUEPPSIB-UHFFFAOYSA-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 = 9263   

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

LigandPNGBDBM9263(2-(but-3-en-1-yloxy)-3-hydroxy-N-[(2R,3S)-2-hydrox...)
Affinity DataKi:  2nM ΔG°:  -11.9kcal/molepH: 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:
5/22/2006
Entry Details Article
PubMed