PDB ligand accession: K0S
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YLIXOWXKFVUKRS-UHFFFAOYSA-N
SMILES: CCCc1nnc(s1)NC(=O)c2ccccn2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridinecarboxylic acids and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5QJF | Download | Experimental | e5qjfA1 e5qjfB1 e5qjfC1 | beta-Grasp beta-Grasp beta-Grasp | LigPlot |