BDBM48306 (6Z)-6-[3-(2-morpholin-4-ylethylsulfanyl)-4-(phenylmethyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one::(6Z)-6-[3-[2-(4-morpholinyl)ethylthio]-4-(phenylmethyl)-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone::(6Z)-6-[4-benzyl-3-(2-morpholin-4-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one::(6Z)-6-[4-benzyl-3-(2-morpholinoethylthio)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one::2-[4-Benzyl-5-(2-morpholin-4-yl-ethylsulfanyl)-4H-[1,2,4]triazol-3-yl]-phenol::MLS000032663::SMR000001966::cid_5770358

SMILES Oc1ccccc1-c1nnc(SCCN2CCOCC2)n1Cc1ccccc1

InChI Key InChIKey=XMGFUWKAUUNDER-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 = 48306   

TargetEstrogen receptor beta(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM48306((6Z)-6-[3-(2-morpholin-4-ylethylsulfanyl)-4-(pheny...)
Affinity DataIC50:  3.51E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay
TargetEstrogen receptor beta(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM48306((6Z)-6-[3-(2-morpholin-4-ylethylsulfanyl)-4-(pheny...)
Affinity DataIC50:  23nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay