PDB ligand accession: 5FJ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: HWSHOMMVLGBIDN-UHFFFAOYSA-N
SMILES: CC(C)(C)NC(=O)c1cncn1C2CCN(CC2)c3ccc(cn3)c4nnc(o4)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Carboxylic acid derivatives
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5DRB | Download | Experimental | e5drbA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |