PDB ligand accession: TQW
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: JWWDOSUXWBDNPH-UHFFFAOYSA-N
SMILES: COc1ccc2c(c1)CCCN2S(=O)(=O)c3ccc(cc3)C=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Hydroquinolines
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7BI3 | Download | Experimental | e7bi3A1 | Repetitive alpha hairpins | LigPlot |