BDBM37102 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloranyl-4-morpholin-4-yl-phenyl)ethanamide::2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-morpholin-4-ylphenyl)acetamide::2-(1,3-benzoxazol-2-ylthio)-N-(3-chloro-4-morpholino-phenyl)acetamide::2-(1,3-benzoxazol-2-ylthio)-N-[3-chloro-4-(4-morpholinyl)phenyl]acetamide::MLS000049822::SMR000077950::cid_1300948

SMILES Clc1cc(NC(=O)CSc2nc3ccccc3o2)ccc1N1CCOCC1

InChI Key InChIKey=WVTICDGJFPMVGB-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 = 37102   

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

Curated by PubChem BioAssay
LigandPNGBDBM37102(2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-morp...)
Affinity DataEC50:  1.02E+3nMAssay 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:
4/29/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM37102(2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-morp...)
Affinity DataEC50:  1.25E+3nMAssay 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:
4/28/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM37102(2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-morp...)
Affinity DataEC50:  1.96E+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:
4/28/2011
Entry Details
PCBioAssay