Ligand name: 1-(4-methylpiperazin-1-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethan-1-one
PDB ligand accession: T67
DrugBank: n/a
PubChem: 145998218
ChEMBL: n/a
InChI Key: XAAUHRXDRLNFFL-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C(=O)Cc2c[nH]c3c2cccn3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyridines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P0DTD1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5RF7	Download	Experimental	e5rf7A1 e5rf7A2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot