BDBM33003 1,2-Bis-(3-amino-4-methyl-phenyl)-ethane-1,2-dione::1,2-bis(3-amino-4-methyl-phenyl)ethane-1,2-dione::1,2-bis(3-amino-4-methylphenyl)ethane-1,2-dione::1,2-bis(3-azanyl-4-methyl-phenyl)ethane-1,2-dione::MLS000780380::SMR000424690::cid_1868544

SMILES Cc1ccc(cc1N)C(=O)C(=O)c1ccc(C)c(N)c1

InChI Key InChIKey=DAEYXUPGJKYJQT-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 = 33003   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 33003BDBM33003(cid_1868544 | 1,2-bis(3-azanyl-4-methyl-phenyl)eth...)
Affinity DataIC50: 1.57E+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
TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 33003BDBM33003(cid_1868544 | 1,2-bis(3-azanyl-4-methyl-phenyl)eth...)
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