Ligand name: 4-[(E)-2-[1-(7-chloranylheptyl)pyridin-1-ium-4-yl]ethenyl]-N,N-dimethyl-aniline
PDB ligand accession: VF2
DrugBank: n/a
PubChem: 132505739;156022792;
ChEMBL: n/a
InChI Key: WTHMXSWCQZGWBE-UHFFFAOYSA-N
SMILES: CN(C)c1ccc(cc1)C=Cc2cc[n+](cc2)CCCCCCCCl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Styrenes

List of PDB structures and/or AlphaFold models with target protein P0A3G3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7OND	Download	Experimental	e7ondA1 e7ondB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
7OO4	Download	Experimental	e7oo4A1	alpha/beta-Hydrolases	LigPlot