Ligand name: 4-[(1R,2S)-2-(4-benzylpiperidin-1-yl)-1-hydroxypropyl]phenol
PDB ligand accession: QEL
DrugBank: n/a
PubChem: 6604117
ChEMBL: CHEMBL49623
InChI Key: UYNVMODNBIQBMV-KKSFZXQISA-N
SMILES: CC(C(c1ccc(cc1)O)O)N2CCC(CC2)Cc3ccccc3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Piperidines
      • Subclass: Benzylpiperidines

List of PDB structures and/or AlphaFold models with target protein Q13224

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5EWJ	Download	Experimental	e5ewjB1 e5ewjB2 e5ewjA2 e5ewjD1 e5ewjD2 e5ewjC2	Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like	LigPlot