Ligand name: 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME
PDB ligand accession: HBP
DrugBank: n/a
PubChem: 73155752;135412777;135444708;135998834;
ChEMBL: CHEMBL1187858
InChI Key: NJSMUQMHXZRXQC-UHFFFAOYSA-P
SMILES: c1cc[n+](c(c1)C=NO)CCCCCCC[n+]2ccccc2C=NO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Pyridinium derivatives

List of PDB structures and/or AlphaFold models with target protein P21836

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2GYV	Download	Experimental	e2gyvA1 e2gyvB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
2WU4	Download	Experimental	e2wu4A1 e2wu4B1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
2JF0	Download	Experimental	e2jf0A1 e2jf0B1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot