BDBM33531 3-[(4-chlorobenzoyl)amino]-1H-1,2,4-triazole-5-carboxylic acid methyl ester::3-[[(4-chlorophenyl)-oxomethyl]amino]-1H-1,2,4-triazole-5-carboxylic acid methyl ester::MLS000054995::SMR000065676::cid_2314714::methyl 3-[(4-chlorobenzoyl)amino]-1H-1,2,4-triazole-5-carboxylate::methyl 3-[(4-chlorophenyl)carbonylamino]-1H-1,2,4-triazole-5-carboxylate

SMILES COC(=O)c1nnc(NC(=O)c2ccc(Cl)cc2)[nH]1

InChI Key InChIKey=GYUHSNYCJOUHNH-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 = 33531   

TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33531(3-[(4-chlorobenzoyl)amino]-1H-1,2,4-triazole-5-car...)
Affinity DataIC50:  5.50E+3nMAssay 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 DepthDetails PCBioAssay
TargetProthrombin(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33531(3-[(4-chlorobenzoyl)amino]-1H-1,2,4-triazole-5-car...)
Affinity DataIC50:  37.8nMpH: 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 DepthDetails PCBioAssay