PDB ligand accession: I40
DrugBank: DB07940
PubChem:
ChEMBL: n/a
InChI Key: ZUCWQTWGZGIYPV-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)c(c3c(n2)CCCC3)NCc4cccc(c4)I
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 |
---|---|---|---|---|---|
6XYU | Download | Experimental | e6xyuA1 | alpha/beta-Hydrolases | LigPlot |