PDB ligand accession: B9K
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: IATSSYNKRCFJAY-UHFFFAOYSA-N
SMILES: Cc1c([nH]c(n1)SC)c2ccnc(c2)Nc3ccc(cc3)N4CCOCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Oxazinanes
- Subclass: Morpholines
- Class: Oxazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6EKD | Download | Experimental | e6ekdA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |