BDBM33595 2-[[5-(1-benzofuran-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoic acid::2-[[5-(2-benzofuranyl)-4-phenyl-1,2,4-triazol-3-yl]thio]propanoic acid::2-[[5-(benzofuran-2-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]propionic acid::2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio}propanoic acid::MLS000052543::SMR000082025::cid_2978682

SMILES CC(Sc1nnc(-c2cc3ccccc3o2)n1-c1ccccc1)C(O)=O

InChI Key InChIKey=HEAYNQCRWKRREM-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 = 33595   

TargetProthrombin(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33595(2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazo...)
Affinity DataIC50: 5.00E+4nMpH: 7.5 T: 2°CAssay Description:HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2009
Entry Details
PCBioAssay