BDBM75589 3-[2-(4-bromanylphenoxy)ethoxy]-6-methyl-2-nitro-pyridine::3-[2-(4-bromophenoxy)ethoxy]-6-methyl-2-nitro-pyridine::3-[2-(4-bromophenoxy)ethoxy]-6-methyl-2-nitropyridine::CYM5934::SR-01000055180::SR-01000055180-3::cid_3879894

SMILES Cc1ccc(OCCOc2ccc(Br)cc2)c(n1)[N+]([O-])=O

InChI Key InChIKey=KDWHCKZKHVLFBK-UHFFFAOYSA-N

Data  3 EC50

  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 3 hits for monomerid = 75589   

TargetSphingosine 1-phosphate receptor 4(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM75589(3-[2-(4-bromophenoxy)ethoxy]-6-methyl-2-nitropyrid...)
Affinity DataEC50: >5.00E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 4(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM75589(3-[2-(4-bromophenoxy)ethoxy]-6-methyl-2-nitropyrid...)
Affinity DataEC50:  2.07E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 4(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM75589(3-[2-(4-bromophenoxy)ethoxy]-6-methyl-2-nitropyrid...)
Affinity DataEC50:  2.33E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay