PDB ligand accession: CDD
DrugBank: DB07550
PubChem:
ChEMBL:
InChI Key: ZIGSBBKEPNQXRG-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)CNC(=O)CN2C(=CN=C(C2=O)NCC(c3cccc[n+]3[O-])(F)F)Cl)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrazines
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1MUE | Download | Experimental | e1mue.1 | cradle loop barrel | LigPlot |