BDBM36906 2-[[N-cyano-N'-(2-fluorophenyl)amidino]thio]-N,N-diethyl-acetamide::MLS000078463::N-cyano-N'-(2-fluorophenyl)carbamimidothioic acid [2-(diethylamino)-2-oxoethyl] ester::SMR000041552::[2-(diethylamino)-2-oxidanylidene-ethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate::[2-(diethylamino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate::cid_660825

SMILES CCN(CC)C(=O)CSC(NC#N)=Nc1ccccc1F

InChI Key InChIKey=PIGQHCMDPZJVGR-UHFFFAOYSA-N

Data  3 EC50

  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 3 hits for monomerid = 36906   

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

Curated by PubChem BioAssay
LigandPNGBDBM36906(MLS000078463 | [2-(diethylamino)-2-oxidanylidene-e...)
Affinity DataEC50: >9.50E+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
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36906(MLS000078463 | [2-(diethylamino)-2-oxidanylidene-e...)
Affinity DataEC50: >9.51E+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
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36906(MLS000078463 | [2-(diethylamino)-2-oxidanylidene-e...)
Affinity DataEC50: >9.50E+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:
4/29/2011
Entry Details
PCBioAssay