BDBM45441 (4-bromanylpyrazol-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone::(4-bromo-1-pyrazolyl)-(5-methyl-3-phenyl-4-isoxazolyl)methanone::(4-bromopyrazol-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone::(4-bromopyrazol-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)methanone::4-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-5-methyl-3-phenylisoxazole::MLS000548214::SMR000114904::cid_753182

SMILES Cc1onc(c1C(=O)n1cc(Br)cn1)-c1ccccc1

InChI Key InChIKey=KAQYAAQPJAQBKJ-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 = 45441   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45441BDBM45441(4-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-5-methyl-3-p...)
Affinity DataIC50: 8.62E+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:
5/27/2011
Entry Details
PCBioAssay