BDBM45289 1-(4-{4-[3-(Morpholine-4-sulfonyl)-benzenesulfonyl]-piperazin-1-yl}-phenyl)-ethanone::1-[4-[4-(3-morpholin-4-ylsulfonylphenyl)sulfonylpiperazin-1-yl]phenyl]ethanone::1-[4-[4-(3-morpholinosulfonylphenyl)sulfonylpiperazino]phenyl]ethanone::1-[4-[4-[3-(4-morpholinylsulfonyl)phenyl]sulfonyl-1-piperazinyl]phenyl]ethanone::MLS000076070::SMR000005883::cid_644974

SMILES CC(=O)c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCOCC1

InChI Key InChIKey=UZYRITPJTJTRGM-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 45289   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45289(MLS000076070 | 1-(4-{4-[3-(Morpholine-4-sulfonyl)-...)
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
TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45289(MLS000076070 | 1-(4-{4-[3-(Morpholine-4-sulfonyl)-...)
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