PDB ligand accession: A3W
DrugBank: DB14846
PubChem:
ChEMBL:
InChI Key: ADGGYDAFIHSYFI-UHFFFAOYSA-N
SMILES: c1c(c(cnc1N)c2nc(nc(n2)N3CCOCC3)N4CCOCC4)C(F)(F)F
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Triazines
- Subclass: Aminotriazines
- Class: Triazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5OQ4 | Download | Experimental | e5oq4A4 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |