BDBM50027778 1-Ethynyl Pyrene::CHEMBL1908230

SMILES C#Cc1ccc2ccc3cccc4ccc1c2c34

InChI Key InChIKey=VEBUBSLYGRMOSZ-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50027778   

TargetCytochrome P450 1A1(Rattus norvegicus)
F. Hoffmann-La Roche

Curated by ChEMBL
LigandPNGBDBM50027778(1-Ethynyl Pyrene | CHEMBL1908230)
Affinity DataKi:  20nMAssay Description:Mechanism based inhibition of rat cytochrome P450 CYP1A1 measured by 7-ethoxyresorufin O-deethylation (EROD)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed