BDBM41104 4-(6-methoxy-4-oxidanidyl-quinoxalin-4-ium-2-yl)-3,3-dimethyl-butanoic acid::4-(6-methoxy-4-oxido-2-quinoxalin-4-iumyl)-3,3-dimethylbutanoic acid::4-(6-methoxy-4-oxido-quinoxalin-4-ium-2-yl)-3,3-dimethyl-butyric acid::4-(6-methoxy-4-oxidoquinoxalin-4-ium-2-yl)-3,3-dimethylbutanoic acid::MLS000080463::SMR000037559::cid_665203

SMILES COc1ccc2nc(CC(C)(C)CC(O)=O)c[n+]([O-])c2c1

InChI Key InChIKey=FCAOOSMLUZTAOT-UHFFFAOYSA-N

Data  2 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 41104   

TargetCathepsin B(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM41104(4-(6-methoxy-4-oxidanidyl-quinoxalin-4-ium-2-yl)-3...)
Affinity DataIC50: 5.00E+4nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/11/2011
Entry Details
PCBioAssay
TargetProcathepsin L(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM41104(4-(6-methoxy-4-oxidanidyl-quinoxalin-4-ium-2-yl)-3...)
Affinity DataIC50: 5.00E+4nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay