BDBM50667 1-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-[[(E)-(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea::1-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-3-[[(E)-(3-chloro-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea::1-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-3-[[(E)-(3-chloro-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]thiourea::1-[[(E)-(3-chloro-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-(2-chloro-5-morpholinosulfonyl-phenyl)thiourea::MLS000760375::SMR000369641::cid_6301191

SMILES [O-][N+](=O)c1cc(Cl)c[c-](C=[NH+]NC(=S)Nc2cc(ccc2Cl)S(=O)(=O)N2CCOCC2)c1=O

InChI Key InChIKey=AEKUYQLLYIUDCY-UHFFFAOYSA-O

Data  4 IC50

  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 4 hits for monomerid = 50667   

LigandPNGBDBM50667(SMR000369641 | MLS000760375 | 1-[2-chloro-5-(4-mor...)
Affinity DataIC50: 2.19E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
LigandPNGBDBM50667(SMR000369641 | MLS000760375 | 1-[2-chloro-5-(4-mor...)
Affinity DataIC50: 4.93E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2011
Entry Details
PCBioAssay
TargetBcl-2-like protein 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM50667(SMR000369641 | MLS000760375 | 1-[2-chloro-5-(4-mor...)
Affinity DataIC50: 1.09E+5nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2011
Entry Details
PCBioAssay
TargetPolyphenol oxidase 2(White button mushroom)
Mayoly Spindler

Curated by ChEMBL
LigandPNGBDBM50667(SMR000369641 | MLS000760375 | 1-[2-chloro-5-(4-mor...)
Affinity DataIC50: 7.70E+5nMAssay Description:Inhibition of mushroom tyrosinaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed