PDB ligand accession: 3SC
DrugBank: DB07065
PubChem:
ChEMBL: n/a
InChI Key: AHPKUZJCNHGFQA-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)Cl)Cl)c2cc(n3c(n2)c(cn3)SC#N)NCc4ccncc4
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 |
---|---|---|---|---|---|
2R3P | Download | Experimental | e2r3pA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |