BDBM2461 (6E)-2-(butan-2-ylsulfanyl)-5,5-dimethyl-6-(phenylmethylidene)-3,4,5,6-tetrahydropyrimidin-4-one::S-DABO::thio-DABO 9d

SMILES CCC(C)SC1=N\C(=C\c2ccccc2)C(C)(C)C(=O)N1

InChI Key InChIKey=IZUXEEZJDQOBKE-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 = 2461   

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

LigandPNGBDBM2461(S-DABO | (6E)-2-(butan-2-ylsulfanyl)-5,5-dimethyl-...)
Affinity DataIC50: 4.30E+3nMAssay 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:
12/1/2004
Entry Details Article
PubMed