BDBM33771 (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(benzenesulfonamido)-3-methylbutanoate::(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-methyl-2-(phenylsulfonylamino)butanoate::2-(benzenesulfonamido)-3-methyl-butyric acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester::2-(benzenesulfonamido)-3-methylbutanoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester::MLS000393258::SMR000248052::cid_5131866

SMILES CC(C)C(NS(=O)(=O)c1ccccc1)C(=O)OCc1cc(cc2COCOc12)[N+]([O-])=O

InChI Key InChIKey=KYRKWIBHKORESP-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  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 = 33771   

LigandPNGBDBM33771(SMR000248052 | (6-nitro-4H-1,3-benzodioxin-8-yl)me...)
Affinity DataEC50:  1.57E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support:1R03MH081228-01A1 High-throughput multiplex screening for ABC transporter inhibitors PI: Rich...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2011
Entry Details
PCBioAssay
TargetProthrombin(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33771(SMR000248052 | (6-nitro-4H-1,3-benzodioxin-8-yl)me...)
Affinity DataIC50: 5.00E+4nMpH: 7.5 T: 2°CAssay Description:HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2009
Entry Details
PCBioAssay