Ligand name: N-[2-(4-methylpiperazin-1-yl)-5-nitrophenyl]isoquinolin-1-amine
PDB ligand accession: Q1S
DrugBank: n/a
PubChem: 145704702
ChEMBL: n/a
InChI Key: BAIHXTXZZNBSED-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)c2ccc(cc2Nc3c4ccccc4ccn3)[N+](=O)[O-]
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein P61964

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6U8L	Download	Experimental	e6u8lA1 e6u8lB1	beta-propeller-like beta-propeller-like	LigPlot