PDB ligand accession: R6H
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ISPBCAXOSOLFME-UHFFFAOYSA-N
SMILES: CCOc1cn(nc1C(=O)Nc2ccc(c(c2)F)Oc3ccnc4c3cc(c(c4)OC)OC)c5ccc(cc5C)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7AAX | Download | Experimental | e7aaxA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |