BDBM45725 4-[[(E)-[1-(4-fluorobenzyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]amino]benzoic acid::4-[[(E)-[1-[(4-fluorophenyl)methyl]-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]amino]benzoic acid::4-[[(E)-[1-[(4-fluorophenyl)methyl]-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]amino]benzoic acid::4-{[1-(4-Fluoro-benzyl)-2,4,6-trioxo-tetrahydro-pyrimidin-(5E)-ylidenemethyl]-amino}-benzoic acid::MLS000778442::SMR000415236::cid_6358462

SMILES OC(=O)c1ccc(NC=C2C(=O)NC(=O)N(Cc3ccc(F)cc3)C2=O)cc1

InChI Key InChIKey=WTZGCJGEUGFEHH-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 = 45725   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45725BDBM45725(SMR000415236 | 4-[[(E)-[1-[(4-fluorophenyl)methyl]...)
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
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay