Ligand name: 3-azanyl-5-(azepan-1-yl)-N-carbamimidoyl-6-(2,4-dimethoxypyrimidin-5-yl)pyrazine-2-carboxamide
PDB ligand accession: 32I
DrugBank: n/a
PubChem: 135393475;137348118;
ChEMBL: CHEMBL4206764
InChI Key: GYTXWTOJZQGKDP-UHFFFAOYSA-N
SMILES: COc1c(cnc(n1)OC)c2c(nc(c(n2)C(=O)NC(=N)N)N)N3CCCCCC3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrazines

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
6L04	Download	Experimental	e6l04U1	cradle loop barrel	LigPlot
5ZAJ	Download	Experimental	e5zajU1	cradle loop barrel	LigPlot