PDB ligand accession: 09J
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: JCOILWGRHHMFON-UHFFFAOYSA-N
SMILES: CCN1C(=O)C(=Cc2n1c(nn2)c3c(cccc3Cl)F)c4cc(ccc4C)C(=O)NC5CC5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyridazines and derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3U8W | Download | Experimental | e3u8wA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |