BDBM28358 (2R,7S)-18-chloro-3,3-dimethyl-14-thia-3-azatetracyclo[13.4.0.0^{2,7}.0^{8,13}]nonadeca-1(15),8,10,12,16,18-hexaen-3-ium::ZINC00347698, 27

SMILES [H][C@@]12CCC[N+](C)(C)[C@@]1([H])c1cc(Cl)ccc1Sc1ccccc21

InChI Key InChIKey=VGLYOFIVLPBODU-UHFFFAOYSA-N

Data  2 IC50

  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 2 hits for monomerid = 28358   

TargetTrypanothione reductase(Trypanosoma cruzi)
University of Alberta

LigandPNGBDBM28358((2R,7S)-18-chloro-3,3-dimethyl-14-thia-3-azatetrac...)
Affinity DataIC50: 7.53E+4nMpH: 7.5 T: 2°CAssay Description:Inhibition of TryR was carried out in 96-well plates using a Biotek Precision 2000 automated liquid handler. Reaction was initiated by addition of NA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2009
Entry Details Article
PubMed
TargetTrypanothione reductase(Trypanosoma brucei brucei)
University of Alberta

LigandPNGBDBM28358((2R,7S)-18-chloro-3,3-dimethyl-14-thia-3-azatetrac...)
Affinity DataIC50: 5.87E+4nMAssay Description:Inhibition of TryR was carried out in 96-well plates using a Biotek Precision 2000 automated liquid handler. Reaction was initiated by addition of NA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2009
Entry Details Article
PubMed