BDBM33930 3-[(2-bromobenzoyl)amino]-1H-1,2,4-triazole-5-carboxylic acid methyl ester::3-[[(2-bromophenyl)-oxomethyl]amino]-1H-1,2,4-triazole-5-carboxylic acid methyl ester::MLS001032861::SMR000363482::cid_2314187::methyl 3-[(2-bromobenzoyl)amino]-1H-1,2,4-triazole-5-carboxylate::methyl 3-[(2-bromophenyl)carbonylamino]-1H-1,2,4-triazole-5-carboxylate

SMILES COC(=O)c1nnc(NC(=O)c2ccccc2Br)[nH]1

InChI Key InChIKey=LFZPKEYIGZKMGC-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 = 33930   

TargetProthrombin(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33930(methyl 3-[(2-bromophenyl)carbonylamino]-1H-1,2,4-t...)
Affinity DataIC50: 82.0nMpH: 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
LigandPNGBDBM33930(methyl 3-[(2-bromophenyl)carbonylamino]-1H-1,2,4-t...)
Affinity DataIC50: 72.0nMAssay 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