Ligand name: (3S,5R)-5-{[4-(2-chlorophenyl)-2,2-dimethyl-5-oxopiperazin-1-yl]methyl}-N-(3-methylbutyl)piperidine-3-carboxamide
PDB ligand accession: VYD
DrugBank: n/a
PubChem: 70679349
ChEMBL: CHEMBL2204736
InChI Key: XGYKQWJDBJCEAW-MOPGFXCFSA-N
SMILES: CC(C)CCNC(=O)C1CC(CNC1)CN2CC(=O)N(CC2(C)C)c3ccccc3Cl
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 P00797

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3VYD	Download	Experimental	e3vydA2 e3vydA3 e3vydB2 e3vydB3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot