BDBM33856 MLS000708243::SMR000287710::[5-amino-3-(2-furanyl)-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone::[5-amino-3-(2-furyl)-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone::[5-amino-3-(furan-2-yl)-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone::[5-azanyl-3-(furan-2-yl)-1,2,4-triazol-1-yl]-(2-chlorophenyl)methanone::cid_828593

SMILES Nc1nc(nn1C(=O)c1ccccc1Cl)-c1ccco1

InChI Key InChIKey=JARMYDUXNQNRAF-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 33856   

TargetProthrombin(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33856([5-amino-3-(furan-2-yl)-1,2,4-triazol-1-yl]-(2-chl...)
Affinity DataIC50: 1.40E+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
TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33856([5-amino-3-(furan-2-yl)-1,2,4-triazol-1-yl]-(2-chl...)
Affinity DataIC50: 238nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay