PDB ligand accession: RTN
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: JBOWUKRDBGMOJZ-UHFFFAOYSA-N
SMILES: Cc1ccccc1c2ccc3c(c2)cc(c(n3)N)CCC(=O)NC4CCCCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Phenylquinolines
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3RTN | Download | Experimental | e3rtnA2 e3rtnA3 | cradle loop barrel cradle loop barrel | LigPlot |