Ligand name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[[(2R,3S)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl]thiourea
PDB ligand accession: 74W
DrugBank: n/a
PubChem: 57393641
ChEMBL: CHEMBL1928432
InChI Key: IJDGQXGQAWBJEG-BFHYXJOUSA-N
SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(O2)CNC(=S)Nc3ccc(c(c3)C(F)(F)F)Cl)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: 2',5'-dideoxyribonucleosides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q8I4S1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2YOF	Download	Experimental	e2yofA1 e2yofB1 e2yofC1	P-loop domains-like P-loop domains-like P-loop domains-like	LigPlot