Compound ID | 2326

Update compound information

SCH-79797

Synonym(s): SCH79797  |  SCH 79797

Class: Membrane-active agent

Spectrum of activity: Gram-positive  &  Gram-negative
Details of activity: Active against Neisseria gonorrhoeae, Acinetobacter baumannii, Enterococcus faecalis, and Staphylococcus aureus; dual mode of action, causing inhibition of dihydrofolate reductase and disrupting integrity of the cytoplasmic membrane
Description: Synthetic compound; a human PAR-1 antagonist; dual mechanism; inhibited growth of some mammalian cells (HK-2, HEKL293, and HLF) at concentration required to kill bacteria
Institute where first reported: University of California, San Diego School of Medicine. Department of Molecular Medicine, The Scripps Research Institute.
Year first mentioned: 2018
Development status: Experimental
Chemical structure(s):
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Molecular weight: 371.48
Iso. SMILES: CC(C)C1=CC=C(C=C1)CN2C=CC3=C2C=CC4=C3C(=NC(=N4)NC5CC5)N
InChI Key: AVXQPEKZIGPIJW-UHFFFAOYSA-N
Can. SMILES: CC(C)C1=CC=C(C=C1)CN2C=CC3=C4C(=CC=C32)N=C(NC5CC5)N=C4N
InChI: InChI=1S/C23H25N5/c1-14(2)16-5-3-15(4-6-16)13-28-12-11-18-20(28)10-9-19-21(18)22(24)27-23(26-19)25-17-7-8-17/h3-6,9-12,14,17H,7-8,13H2,1-2H3,(H3,24,25,26,27)
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/4259181
Guide to Pharmacology: SCH-79797
Citations:
  • https://academic.oup.com/jac/article/73/6/1586/4921301?searchresult=1
  • https://www.cell.com/cell/fulltext/S0092-8674(20)30567-5

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