Ligand name: tert-butyl {(3S,5R)-5-[cyclopropyl(2,3-dichlorobenzyl)carbamoyl]piperidin-3-yl}carbamate
PDB ligand accession: 2XF
DrugBank: n/a
PubChem: 78350457
ChEMBL: CHEMBL3318932
InChI Key: VPHFZAIDKCROMZ-CABCVRRESA-N
SMILES: CC(C)(C)OC(=O)NC1CC(CNC1)C(=O)N(Cc2cccc(c2Cl)Cl)C3CC3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

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
4PYV	Download	Experimental	e4pyvA1 e4pyvA2 e4pyvB1 e4pyvB2	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot