BDBM33716 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)thio]acetic acid ethyl ester::MLS000327765::SMR000180812::cid_3778136::ethyl 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)sulfanyl]acetate::ethyl 2-[(5-benzamido-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate::ethyl 2-{[3-(benzoylamino)-1H-1,2,4-triazol-5-yl]sulfanyl}acetate

SMILES CCOC(=O)CSc1nnc(NC(=O)c2ccccc2)[nH]1

InChI Key InChIKey=YFOBXIFGQIGNEC-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 33716   

TargetProthrombin(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33716(2-[(5-benzamido-1H-1,2,4-triazol-3-yl)thio]acetic ...)
Affinity DataIC50:  862nMpH: 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
TargetKallikrein-5(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33716(2-[(5-benzamido-1H-1,2,4-triazol-3-yl)thio]acetic ...)
Affinity DataIC50:  1.50E+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
TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33716(2-[(5-benzamido-1H-1,2,4-triazol-3-yl)thio]acetic ...)
Affinity DataIC50:  945nMAssay 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