PDB ligand accession: 7JU
DrugBank: n/a
PubChem: 90258104;135567272;
ChEMBL: n/a
InChI Key: UPRNZWUAFGVMOP-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2cc3c(c(c2F)O)N=CNC3=O)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 |
---|---|---|---|---|---|
5PA2 | Download | Experimental | e5pa2A1 | Rossmann-like | LigPlot |