PDB ligand accession: 9NQ
DrugBank: DB16217
PubChem:
ChEMBL:
InChI Key: MWKYMZXCGYXLPL-ZDUSSCGKSA-N
SMILES: CCC(=O)N1CCC(C1)Nc2c3c(ncn2)CCN(C3)c4cc(c(nc4)OC)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridopyrimidines
- Subclass: None
- Class: Pyridopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5O83 | Download | Experimental | e5o83A4 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |