BDBM50142984 2-[3-[2R-Hydroxy-2-(10S-isopropyl-8,11-dioxo-2-oxa-9,-12-diaza-bicyclo[13.2.2]nonadeca-1(18),15(19),16-trien-13-yl)-ethyl]-3-(3-methylbutyl)ureido]-3-methylbutyricAcid::CHEMBL42946

SMILES CC(C)CCN(C[C@@H](O)[C@@H]1Cc2ccc(OCCCCCC(=O)N[C@@H](C(C)C)C(=O)N1)cc2)NC(=O)NC(=O)[C@@H](N)C(C)C

InChI Key InChIKey=OXJXMTHQHZLPSB-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 = 50142984   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
The University of Queensland

Curated by ChEMBL
LigandPNGBDBM50142984(2-[3-[2R-Hydroxy-2-(10S-isopropyl-8,11-dioxo-2-oxa...)
Affinity DataKi:  2.00E+4nMAssay Description:Tested for inhibition of synthetic HIV-1 protease by using fluorometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed