Drug Information

Drug General Information
Drug ID
D0U0BV
Former ID
DNC007669
Drug Name
1,2-bis(3,4-difluorophenyl)-2-hydroxyethanone
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528766]
Formula
C14H8F4O2
Canonical SMILES
C1=CC(=C(C=C1C(C(=O)C2=CC(=C(C=C2)F)F)O)F)F
InChI
1S/C14H8F4O2/c15-9-3-1-7(5-11(9)17)13(19)14(20)8-2-4-10(16)12(18)6-8/h1-6,13,19H
InChIKey
VPCIITRKAXBIRA-UHFFFAOYSA-N
PubChem Compound ID
44428830
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.

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