PDB ligand accession: CDA
DrugBank: DB07548
PubChem:
ChEMBL:
InChI Key: JXHWVKOKYDAROD-UHFFFAOYSA-N
SMILES: CC1=CN=C(C(=O)N1CC(=O)NCc2c(cccn2)F)NCC(c3ccccn3)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrazines
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1MU6 | Download | Experimental | e1mu6.1 | cradle loop barrel | LigPlot |