BDBM24743 (2S)-6-amino-N-[(2S)-5-carbamimidamido-1-oxopentan-2-yl]-2-[(2S)-5-(carbamoylamino)-2-(1-phenylacetamido)pentanamido]hexanamide::Capped tripeptide aldehyde inhibitor, 31

SMILES [#7]-[#6]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#7]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6]=O

InChI Key InChIKey=YSVNWIKGOPNLJC-ACRUOGEOSA-N

Data  1 KI  1 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 1 hit for monomerid = 24743   

TargetGenome polyprotein [1424-1463]/[1502-1685](West Nile virus (WNV))
University Of Queensland

LigandPNGBDBM24743((2S)-6-amino-N-[(2S)-5-carbamimidamido-1-oxopentan...)
Affinity DataKi:  111nM ΔG°:  -9.86kcal/mole IC50:  619nMpH: 9.5 T: 2°CAssay Description:Inhibition of WNV protease activity was measured using recombinant WNV protease, which first incubated with inhibitor in 96-well plates. Catalysis wa...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed