Ligand name: (1R,3AS,4R,8AS,8BR)-4-(2-BENZO[1,3]DIOXOL-5-YL-1-CYCLOPROPYL-3-OXO-DECAHYDRO-PYRROLO[3,4-A]PYRROLIZIN-4-YL)-BENZAMIDINE
PDB ligand accession: UIR
DrugBank: n/a
PubChem: 5326920
ChEMBL: n/a
InChI Key: XYMBMAVAMICSMV-FTSNLURZSA-N
SMILES: c1cc(ccc1C2C3C(C4N2CCC4)C(N(C3=O)Cc5ccc6c(c5)OCO6)C7CC7)C(=N)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolidines
      • Subclass: Phenylpyrrolidines

List of PDB structures and/or AlphaFold models with target protein P00760

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1Y3Y	Download	Experimental	e1y3yA1	cradle loop barrel	LigPlot
1Y3V	Download	Experimental	e1y3vA1	cradle loop barrel	LigPlot