BDBM32692 2-[[4-(3-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetic acid methyl ester::MLS000067843::SMR000122444::[4-(3-Methoxy-phenyl)-5-methyl-4H-[1,2,4]triazol-3-ylsulfanyl]-acetic acid methyl ester::cid_1451140::methyl 2-[[4-(3-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate::methyl 2-[[4-(3-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate

SMILES COC(=O)CSc1nnc(C)n1-c1cccc(OC)c1

InChI Key InChIKey=AOIHZLCKLGKTMY-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 = 32692   

TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32692([4-(3-Methoxy-phenyl)-5-methyl-4H-[1,2,4]triazol-3...)
Affinity DataIC50: 2.36E+3nMpH: 7.4 T: 2°CAssay Description:Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/26/2009
Entry Details
PCBioAssay
TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32692([4-(3-Methoxy-phenyl)-5-methyl-4H-[1,2,4]triazol-3...)
Affinity DataIC50: 2.36E+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 Depth
Date in BDB:
4/30/2011
Entry Details
PCBioAssay