PDB ligand accession: E7T
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VZPLUSXTJULLCS-SYQZRHMFSA-N
SMILES: CCC1CC(C(c2c1c(c(c(c2)F)F)O)Nc3cccc4c3C=CC(=O)N4)(C(F)(F)F)O
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 |
---|---|---|---|---|---|
5G3J | Download | Experimental | e5g3jA1 | Nuclear receptor ligand-binding domain | LigPlot |