PDB ligand accession: 4RB
DrugBank: DB07125
PubChem:
ChEMBL: n/a
InChI Key: KKZYGUVAFJCULH-CYBMUJFWSA-N
SMILES: CCC(CO)Nc1ccc2ncc(n2n1)c3ccc(cc3)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Imidazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3BQR | Download | Experimental | e3bqrA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |