BDBM33425 5-(1-benzoyl-3-piperidinyl)-3-(phenylmethyl)-2H-triazolo[4,5-d]pyrimidin-7-one::5-(1-benzoyl-3-piperidyl)-3-benzyl-2H-triazolo[4,5-d]pyrimidin-7-one::5-(1-benzoylpiperidin-3-yl)-3-benzyl-2H-triazolo[4,5-d]pyrimidin-7-one::5-[1-(phenylcarbonyl)piperidin-3-yl]-3-(phenylmethyl)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one::MLS000069005::SMR000007422::[3-(3-Benzyl-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl)-piperidin-1-yl]-phenyl-methanone::cid_648416

SMILES O=C(c1ccccc1)N1CCCC(c2nc3c(nnn3Cc3ccccc3)c(=O)[nH]2)C1

InChI Key InChIKey=LPIUNLQZZIKWNV-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 33425   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 33425BDBM33425(5-(1-benzoylpiperidin-3-yl)-3-benzyl-2H-triazolo[4...)
Affinity DataIC50: 5.00E+4nMpH: 7.4 T: 2°CAssay Description:HTS was performed on a total of 33,068 compounds of the MLSCN library, 23,017 of which were not in the mixture HTS plates used previously. These comp...More data for this Ligand-Target Pair
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Date in BDB:
11/9/2009
Entry Details
PCBioAssay