Compound ID | 2524

Update compound information

Halicin

Synonym(s): SU3327  |  SU-3327  |  EN-7

Class: Small molecule antibacterial agent

Agent Type: Synthetic; Small molecule; Direct acting;
Spectrum of activity: Gram-positive, Gram-negative & Antimycobacterial
Mechanism of action: Membrane-active agent. Dissipates proton motive force/ disrupts the maintainance of an electrochemical gradient across the membrane
Target Pathogen: Active against Escherichia coli, Acinetobacter baumannii, Clostridium difficile, Staphylococcus aureus, and Mycobacterium tuberculosis
Description: Synthetic compound from Drug Repurposing Hub (additionally including natural products from plant, animal, and microbial sources) identified by deep learning method/machine learning predicted to have inhibitory property; reduced bacterial load to <10^3 CFU/ml in murine model of infection
Year first mentioned: 2019
Development status: Experimental
Chemical structure(s):
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Molecular weight: 261.31
Iso. SMILES: C1=C(SC(=N1)SC2=NN=C(S2)N)[N+](=O)[O-]
InChI Key: NQQBNZBOOHHVQP-UHFFFAOYSA-N
Can. SMILES: C1=C([N+](=O)[O-])SC(=N1)SC2=NN=C(N)S2
InChI: InChI=1S/C5H3N5O2S3/c6-3-8-9-5(14-3)15-4-7-1-2(13-4)10(11)12/h1H,(H2,6,8)
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/11837140
Guide to Pharmacology: SU-3327
Citations:
  • https://pmc.ncbi.nlm.nih.gov/articles/PMC8698312/
  • https://www.cell.com/cell/fulltext/S0092-8674(20)30102-1

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