BDBM2885 5-Chloro-3,4-dihydro-6-fluoro-4-[(2-pyridyl)ethynyl]-4-(trifluoromethyl)-2(1H)-quinazolinone::5-chloro-6-fluoro-4-[2-(pyridin-2-yl)ethynyl]-4-(trifluoromethyl)-1,2,3,4-tetrahydroquinazolin-2-one::Trifluromethylquinazolinone deriv. 30

SMILES Fc1ccc2NC(=O)NC(C#Cc3ccccn3)(c2c1Cl)C(F)(F)F

InChI Key InChIKey=ZWFRSEVTEKENQN-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 2885   

TargetGag-Pol polyprotein [588-1027]/[588-1147](Human immunodeficiency virus type 1)
Dupont Pharmaceuticals

LigandPNGBDBM2885(5-Chloro-3,4-dihydro-6-fluoro-4-[(2-pyridyl)ethyny...)
Affinity DataIC50:  80nMpH: 8.2 T: 37°CAssay 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 DepthDetails ArticlePubMed