BDBM109230 CB29 (derivative 20)

SMILES CC(=O)Nc1ccc(Oc2ccc(cc2[N+]([O-])=O)S(=O)(=O)C(F)(F)F)cc1

InChI Key InChIKey=KMLYOGCQTNVFEX-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 109230   

LigandPNGBDBM109230(CB29 (derivative 20))
Affinity DataIC50: 1.00E+5nMAssay Description:To determine the IC50 values for CB29 and its analogues, propionaldehyde was used as the substrate for ALDH1A1 and ALDH2 and benzaldehyde was used as...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/16/2014
Entry Details Article
PubMed