PDB ligand accession: KSS
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: VCAREOFNIBYKAE-UHFFFAOYSA-N
SMILES: CCSc1nc(cc2n1ccn2)c3ccc(c(c3)OC)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrimidines and pyrimidine derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3ACJ | Download | Experimental | e3acjA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |