BDBM32975 (4-chlorophenyl)sulfonyl-[3-[3-(phenylmethyl)-1-imidazol-3-iumyl]-2-quinoxalinyl]azanide::(4-chlorophenyl)sulfonyl-[3-[3-(phenylmethyl)imidazol-3-ium-1-yl]quinoxalin-2-yl]azanide::MLS001012277::SMR000425085::[3-(3-benzylimidazol-3-ium-1-yl)quinoxalin-2-yl]-(4-chlorophenyl)sulfonyl-azanide::[3-(3-benzylimidazol-3-ium-1-yl)quinoxalin-2-yl]-(4-chlorophenyl)sulfonylazanide::cid_1390207

SMILES Clc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1-n1cc[n+](Cc2ccccc2)c1

InChI Key InChIKey=VHOQRDOZGRCZBD-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 = 32975   

TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32975BDBM32975((4-chlorophenyl)sulfonyl-[3-[3-(phenylmethyl)imida...)
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
In Depth
Date in BDB:
10/26/2009
Entry Details
PCBioAssay
TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32975BDBM32975((4-chlorophenyl)sulfonyl-[3-[3-(phenylmethyl)imida...)
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