BDBM32678 1-(5-methylsulfanyl-3-phenyl-1,2,4-triazol-1-yl)butan-1-one::1-[5-(methylthio)-3-phenyl-1,2,4-triazol-1-yl]-1-butanone::1-[5-(methylthio)-3-phenyl-1,2,4-triazol-1-yl]butan-1-one::1-butyryl-3-phenyl-1H-1,2,4-triazol-5-ylmethylsulfide::MLS000550153::SMR000113998::cid_828558
SMILES CCCC(=O)n1nc(nc1SC)-c1ccccc1
InChI Key InChIKey=SHTPAJZHXKCXLP-UHFFFAOYSA-N
Data 3 IC50
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 3 hits for monomerid = 32678
Affinity DataIC50: 935nMpH: 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
Affinity DataIC50: >5.00E+4nMAssay 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
Affinity DataIC50: >5.00E+4nMpH: 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