Ligand name: methyl (4R)-4-(2-chloro-4-fluorophenyl)-6-{[4-(3-hydroxypenta-1,4-diyn-3-yl)piperidin-1-yl]methyl}-2-(pyridin-2-yl)-1,4-dihydropyrimidine-5-carboxylate
PDB ligand accession: 58H
DrugBank: n/a
PubChem: 71494135
ChEMBL: n/a
InChI Key: GKZRJYVILONFJM-UHFFFAOYSA-N
SMILES: COC(=O)C1=C(NC(=NC1c2ccc(cc2Cl)F)c3ccccn3)CN4CCC(CC4)C(C#C)(C#C)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrimidines and pyrimidine derivatives

List of PDB structures and/or AlphaFold models with target protein P03147

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5D7Y	Download	Experimental	e5d7yB1 e5d7yC1 e5d7yC1	Hepatitis B viral capsid (hbcag) Hepatitis B viral capsid (hbcag) Hepatitis B viral capsid (hbcag)	LigPlot