Ligand name: 3-azanyl-5-(azepan-1-yl)-6-(1-benzofuran-2-yl)-Ncarbamimidoyl-pyrazine-2-carboxamide
PDB ligand accession: 50I
DrugBank: n/a
PubChem: 135393470;137348301;
ChEMBL: CHEMBL4213248
InChI Key: FSPGYSVEHLETQR-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)cc(o2)c3c(nc(c(n3)C(=O)NC(=N)N)N)N4CCCCCC4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzofurans
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P00749

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5ZA9	Download	Experimental	e5za9U1	cradle loop barrel	LigPlot
6L05	Download	Experimental	e6l05U1	cradle loop barrel	LigPlot