Halicin

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

Class: Membrane-active agent

Spectrum of activity:	Gram-positive  &  Gram-negative
Details of activity:	Active against Escherichia coli, Acinetobacter baumannii, Clostridium difficile, Staphylococcus aureus, and Mycobacterium tuberculosis; dissipates proton motive force/ disrupts the maintainance of an electrochemical gradient across the membrane
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):
Canonical SMILES:	C1=C([N+](=O)[O-])SC(=N1)SC2=NN=C(N)S2
Isomeric SMILES:	C1=C(SC(=N1)SC2=NN=C(S2)N)[N+](=O)[O-]
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)
InChI Key:	NQQBNZBOOHHVQP-UHFFFAOYSA-N
Structure link:	https://pubchem.ncbi.nlm.nih.gov/compound/11837140

External links:
Main Source:	https://www.cell.com/cell/fulltext/S0092-8674(20)30102-1
Citation:	https://pmc.ncbi.nlm.nih.gov/articles/PMC8698312/