Ligand name: (3S)-N-(pyrimidin-2-yl)azepan-3-amine
PDB ligand accession: LES
DrugBank: n/a
PubChem: 138753311
ChEMBL: n/a
InChI Key: PFXDAYBNPUUKPB-VIFPVBQESA-N
SMILES: c1cnc(nc1)NC2CCCCNC2
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q8IU60

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5QOS	Download	Experimental	e5qosA1	beta-Grasp	LigPlot