Ligand name: 1-{4-[6-chloro-7-(2-fluorophenyl)quinazolin-4-yl]piperazin-1-yl}propan-1-one
PDB ligand accession: 8ZG
DrugBank: n/a
PubChem: 137348773
ChEMBL: n/a
InChI Key: JPFKOCMCIFOGHK-UHFFFAOYSA-N
SMILES: CCC(=O)N1CCN(CC1)c2c3cc(c(cc3ncn2)c4ccccc4F)Cl
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 P01116

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6B0Y	Download	Experimental	e6b0yA1 e6b0yB1	P-loop domains-like P-loop domains-like	LigPlot
5V71	Download	Experimental	e5v71A1 e5v71B1 e5v71C1 e5v71C1 e5v71D1 e5v71B1 e5v71E1 e5v71A1 e5v71F1	P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like P-loop domains-like	LigPlot