Compound ID | 2326
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): | |
Canonical SMILES: | CC(C)C1=CC=C(C=C1)CN2C=CC3=C4C(=CC=C32)N=C(NC5CC5)N=C4N |
Isomeric SMILES: | CC(C)C1=CC=C(C=C1)CN2C=CC3=C2C=CC4=C3C(=NC(=N4)NC5CC5)N |
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) |
InChI Key: | AVXQPEKZIGPIJW-UHFFFAOYSA-N |
Structure link: | https://pubchem.ncbi.nlm.nih.gov/compound/4259181 |
External links: | |
Guide to Pharmacology: | SCH-79797 |
Main Source: | https://www.cell.com/cell/fulltext/S0092-8674(20)30567-5 |
Citation: | https://academic.oup.com/jac/article/73/6/1586/4921301?searchresult=1 |