PDB ligand accession: VPJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YMCUEXLWILKXTO-UHFFFAOYSA-N
SMILES: c1cc(ccc1Nc2nc(nc(n2)N)CSc3nnc(s3)NCC4CCCO4)F
Drug action: n/a
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 |
---|---|---|---|---|---|
7JYQ | Download | Experimental | e7jyqA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |