PDB ligand accession: CQA
DrugBank: DB00613
PubChem: 2165;3647519;
ChEMBL:
InChI Key: OVCDSSHSILBFBN-UHFFFAOYSA-N
SMILES: CCN(CC)Cc1cc(ccc1O)Nc2ccnc3c2ccc(c3)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Aminoquinolines and derivatives
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4MWZ | Download | Experimental | e4mwzB1 | Rossmann-like | LigPlot |