PDB ligand accession: A55
DrugBank: DB07318
PubChem:
ChEMBL: n/a
InChI Key: BOAUWUUBSXECNL-LLVKDONJSA-N
SMILES: c1cc(c2c(c1F)C(=NC(N2)CCNC(=O)c3ccoc3)N)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 |
---|---|---|---|---|---|
3E6O | Download | Experimental | e3e6oA1 e3e6oB1 | Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain | LigPlot |