BDBM13036 ((+/-)-7-Ethylsulfonyl-3-fluoromethyl-1,2,3,4-tetrahydroisoquinoline::7-(ethanesulfonyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline::7-sulfonyl-THIQ 26

SMILES CCS(=O)(=O)c1ccc2CC(CF)NCc2c1

InChI Key InChIKey=IVBUQXPWGXLDMG-UHFFFAOYSA-N

Data  1 KI

  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 1 hit for monomerid = 13036   

TargetPhenylethanolamine N-methyltransferase(Homo sapiens (Human))
University of Kansas

LigandPNGBDBM13036(((+/-)-7-Ethylsulfonyl-3-fluoromethyl-1,2,3,4-tetr...)
Affinity DataKi:  1.40E+4nM ΔG°:  -6.88kcal/molepH: 8.0 T: 2°CAssay Description:Enzyme activity is determined by measuring the amount of 3H incorporated into the substrate during the reaction. AdoMet/[methyl-3H]AdoMet serves as a...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed