PDB ligand accession: Y22
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FEJSMMIZTOMLEL-UHFFFAOYSA-N
SMILES: c1cc(ccc1CNc2c(nc3ccc(cc3n2)C(F)(F)F)C(=O)O)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4P8C | Download | Experimental | e4p8cA1 e4p8cA2 e4p8cB1 e4p8cB2 | Alpha-beta plaits FAD-binding domain-like FAD-binding domain-like Alpha-beta plaits | LigPlot |