BDBM3115 3,4-Dihydroquinazolinon 4i::6-chloro-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl]-1,2,3,4-tetrahydroquinazolin-2-one

SMILES [O-][N+](=O)c1ccccc1C#CC1(NC(=O)Nc2ccc(Cl)cc12)C1CC1

InChI Key InChIKey=BXKCPLKQZJHTRJ-UHFFFAOYSA-N

Data  1 IC50

  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 = 3115   

TargetGag-Pol polyprotein [588-1027]/[588-1147](Human immunodeficiency virus type 1)
Merck Research Laboratories

LigandPNGBDBM3115(6-chloro-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl...)
Affinity DataIC50: 12.8nMpH: 8.2Assay Description:The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/24/2005
Entry Details Article
PubMed