BDBM50163379 ((1S,2R)-1-Benzyl-2-hydroxy-3-{isobutyl-[2-(2-pyrrolidin-1-yl-ethylamino)-benzothiazole-6-sulfonyl]-amino}-propyl)-carbamic acid (3R,3aS,6aR)-(hexahydro-furo[2,3-b]furan-3-yl) ester::CHEMBL436082

SMILES CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)c1ccc2nc(NCCN3CCCC3)sc2c1

InChI Key InChIKey=ZCNACGKIKDEZFC-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50163379   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Tibotec

Curated by ChEMBL
LigandPNGBDBM50163379(((1S,2R)-1-Benzyl-2-hydroxy-3-{isobutyl-[2-(2-pyrr...)
Affinity DataKd:  0.100nMAssay Description:Binding affinity against HIV-1 proteaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed