Ligand name: 5-[2-(3,5-dimethoxyphenyl)ethyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
PDB ligand accession: W75
DrugBank: n/a
PubChem: 73010361
ChEMBL: CHEMBL3990712
InChI Key: WVWPBPAOHICERF-UHFFFAOYSA-N
SMILES: COc1cc(cc(c1)OC)CCC2=C(NC(=O)NC2=O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q4D3W2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3W75	Download	Experimental	e3w75A1 e3w75B1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot