PDB ligand accession: ES1
DrugBank: n/a
PubChem: 69141;5280925;
ChEMBL:
InChI Key: PMZDQRJGMBOQBF-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)c(ccn2)O
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 |
---|---|---|---|---|---|
8EH1 | Download | Experimental | e8eh1A1 e8eh1A2 e8eh1B1 e8eh1B2 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |