PDB ligand accession: 8WH
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: PJYOPNLTNBDQPR-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)C(=O)O)Cn2cc(nn2)c3cccc4c3N=C(CC4=O)N5CCOCC5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Quinolones and derivatives
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5NGB | Download | Experimental | e5ngbA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |