PDB ligand accession: D8Y
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XJCJGDOLNLEZIY-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)Cl)CCc2cccnc2N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Aminopyridines and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3KMY | Download | Experimental | e3kmyA2 e3kmyA3 e3kmyB2 e3kmyB3 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |