PDB ligand accession: 1CX
DrugBank: DB06892
PubChem: n/a
ChEMBL: n/a
InChI Key: BDLJJGJCIWWATJ-OOHURIHSSA-N
SMILES: c1cc(c(cc1I)F)N=C2C(C(=CC=C2C(=O)NOCCO)F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Halobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3DY7 | Download | Experimental | e3dy7A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |