Ligand name: ~{N}-[(1~{S})-2-(1,3-benzodioxol-5-ylmethylamino)-1-(3-hydroxyphenyl)-2-oxidanylidene-ethyl]-~{N}-propyl-prop-2-enamide
PDB ligand accession: UQZ
DrugBank: n/a
PubChem: 155923525
ChEMBL: n/a
InChI Key: BMXUYKHPBOFWRQ-NRFANRHFSA-N
SMILES: CCCN(C(c1cccc(c1)O)C(=O)NCc2ccc3c(c2)OCO3)C(=O)C=C
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 P0DTC1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7NT3	Download	Experimental	e7nt3A2 e7nt3B1 e7nt3B2	cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot