PDB ligand accession: CQO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZFOMCSNUEHMROO-UHFFFAOYSA-N
SMILES: COc1ccc2c(c1)c(c3cc(ccc3n2)OC)SCCCN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Benzoquinolines
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6K0J | Download | Experimental | e6k0jA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |