Drug Information

Drug General Information
Drug ID
D05YJP
Former ID
DNC007066
Drug Name
Ethyl 3-(biphenyl-3-ylamino)-2-cyanoacrylate
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528617]
Structure
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2D MOL

3D MOL
Formula
C18H16N2O2
Canonical SMILES
CCOC(=O)C(=CNC1=CC=CC(=C1)C2=CC=CC=C2)C#N
InChI
1S/C18H16N2O2/c1-2-22-18(21)16(12-19)13-20-17-10-6-9-15(11-17)14-7-4-3-5-8-14/h3-11,13,20H,2H2,1H3/b16-13-
InChIKey
RHZLPWXPGLGMLM-SSZFMOIBSA-N
PubChem Compound ID
16102644
Target and Pathway
Target(s) Dihydroorotate dehydrogenase, mitochondrial Target Info Inhibitor [528617]
KEGG Pathway Pyrimidine metabolism
Metabolic pathways
PathWhiz Pathway Pyrimidine Metabolism
Reactome Pyrimidine biosynthesis
WikiPathways Metabolism of nucleotides
References
Ref 528617J Med Chem. 2007 Jan 25;50(2):186-91.Design and synthesis of potent inhibitors of the malaria parasite dihydroorotate dehydrogenase.
Ref 528617J Med Chem. 2007 Jan 25;50(2):186-91.Design and synthesis of potent inhibitors of the malaria parasite dihydroorotate dehydrogenase.

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