PDB ligand accession: 0J2
DrugBank: n/a
PubChem: 56851699;135566689;
ChEMBL: n/a
InChI Key: KXEAQLNQKVKEGT-GSVOUGTGSA-N
SMILES: CC(CC(=O)O)C1=NNC2=C(C1=O)C(=O)NC(=N2)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrimidines and pyrimidine derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4D8Z | Download | Experimental | e4d8zA1 e4d8zB2 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |