BDBM45721 1-(4-methoxyphenyl)-3-(3-nitroanilino)pyrrolidine-2,5-dione::1-(4-methoxyphenyl)-3-(3-nitroanilino)pyrrolidine-2,5-quinone::1-(4-methoxyphenyl)-3-[(3-nitrophenyl)amino]pyrrolidine-2,5-dione::MLS000770519::SMR000375870::cid_4276656

SMILES COc1ccc(cc1)-n1c(O)cc(Nc2cccc(c2)[N+]([O-])=O)c1O

InChI Key InChIKey=ZISBHCUPAXOKHI-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 45721   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45721BDBM45721(MLS000770519 | 1-(4-methoxyphenyl)-3-[(3-nitrophen...)
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:
6/8/2011
Entry Details
PCBioAssay
TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45721BDBM45721(MLS000770519 | 1-(4-methoxyphenyl)-3-[(3-nitrophen...)
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