PDB ligand accession: E8D
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: LGIWSHCSALMSPR-UHFFFAOYSA-N
SMILES: c1ccc(cc1)N2CC(=O)Nc3c2nc(nc3)Nc4cc(c(c(c4)F)O)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Amines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6BTW | Download | Experimental | e6btwA1 e6btwB1 e6btwD1 | Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |