Drug General Information
Drug ID
D04CDV
Former ID
DNC007670
Drug Name
1,2-bis(2,6-difluorophenyl)-2-hydroxyethanone
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528766]
Formula
C14H8F4O2
Canonical SMILES
C1=CC(=C(C(=C1)F)C(C(=O)C2=C(C=CC=C2F)F)O)F
InChI
1S/C14H8F4O2/c15-7-3-1-4-8(16)11(7)13(19)14(20)12-9(17)5-2-6-10(12)18/h1-6,13,19H
InChIKey
JVCMBBUYARXRIK-UHFFFAOYSA-N
PubChem Compound ID
Target and Pathway
Target(s) Liver carboxylesterase Target Info Inhibitor [528766]
KEGG Pathway Drug metabolism - other enzymes
Metabolic pathways
Pathway Interaction Database E2F transcription factor network
WikiPathways NRF2 pathway
Nuclear Receptors Meta-Pathway
Heroin metabolism
Irinotecan Pathway
Fluoropyrimidine Activity
Phase I biotransformations, non P450
References
Ref 528766Bioorg Med Chem. 2007 Jun 1;15(11):3801-17. Epub 2007 Mar 12.Analysis of the inhibition of mammalian carboxylesterases by novel fluorobenzoins and fluorobenzils.
Ref 528766Bioorg Med Chem. 2007 Jun 1;15(11):3801-17. Epub 2007 Mar 12.Analysis of the inhibition of mammalian carboxylesterases by novel fluorobenzoins and fluorobenzils.