Halicin

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

Class: Thiadiazole

Spectrum of activity:	Gram-positive  &  Gram-negative
Details of activity:	Disrupts the maintainance of an electrochemical gradient across the membrane. Activity against E. coli, Acinetobacter and Mycobacterium tuberculosis
Description:	Synthetic compound; repurposed c-Jun N-terminal kinase inhibitor SU3327 (diabetic treatment) through machine learning modeling and experimental design.
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.ncbi.nlm.nih.gov/pmc/articles/PMC8349178/
Citations:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8698312/ https://www.sciencedirect.com/science/article/pii/S2666246922000076