BDBM2356 2-(butan-2-ylsulfanyl)-6-[(3-nitrophenyl)methyl]-3,4-dihydropyrimidin-4-one::S-DABO::thio-DABO 5h

SMILES CCC(C)Sc1nc(Cc2cccc(c2)[N+]([O-])=O)cc(=O)[nH]1

InChI Key InChIKey=MPHANATUQIGHMY-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 = 2356   

TargetGag-Pol polyprotein [588-1027]/[588-1147](Human immunodeficiency virus type 1)
Sapienza University of Rome

LigandPNGBDBM2356(S-DABO | 2-(butan-2-ylsulfanyl)-6-[(3-nitrophenyl)...)
Affinity DataIC50: 300nMpH: 7.8 T: 2°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 Depth
Date in BDB:
11/23/2004
Entry Details Article
PubMed