BDBM39334 MLS000073448::N-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-2-(5-furan-2-yl-4-propyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide::N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[5-(2-furanyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide::N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[5-(2-furyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide::N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide::N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide::SMR000005970::cid_652236

SMILES CCCn1c(SCC(=O)Nc2ccc3OCCOc3c2)nnc1-c1ccco1

InChI Key InChIKey=KVKFNLHGJLIHJD-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 = 39334   

TargetGenome polyprotein(WNV)
University of Pittsburgh

Curated by PubChem BioAssay
LigandPNGBDBM39334(MLS000073448 | N-(2,3-dihydro-1,4-benzodioxin-6-yl...)
Affinity DataIC50: 5.00E+4nMAssay Description:The HTS assay to identify Inhibitors of West Nile Virus (WNV) NS2bNS3 Proteinase was proposed by Dr Alex Strongin of the Burnham Institute XO1-MH0776...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2011
Entry Details
PCBioAssay