PDB ligand accession: KVB
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VXHRQVMQVYQGQG-UHFFFAOYSA-N
SMILES: c1ccc(cc1)Cc2cnc3c(c2c4cccc(c4)OCc5ccc(cc5)CC(=O)O)cccc3C(F)(F)F
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 |
---|---|---|---|---|---|
6S4T | Download | Experimental | e6s4tA1 | Nuclear receptor ligand-binding domain | LigPlot |