Ligand name: N'-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-[(2R,4S)-4-ETHOXYPIPERIDIN-2-YL]-2-HYDROXYETHYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE
PDB ligand accession: SC7
DrugBank: n/a
PubChem: 11592145
ChEMBL: CHEMBL257278
InChI Key: JWYOKBPWLVCFKU-ICYKMPLBSA-N
SMILES: CCCN(CCC)C(=O)c1cc(cc(c1)C(=O)NC(Cc2cc(cc(c2)F)F)C(C3CC(CCN3)OCC)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Toluenes

List of PDB structures and/or AlphaFold models with target protein P56817

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2QP8	Download	Experimental	e2qp8A2 e2qp8A3 e2qp8B2 e2qp8B3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot