PDB ligand accession: CVN
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KVAIBQQTUBXORG-UHFFFAOYSA-N
SMILES: c1cc(c2c(c1)ONC2=O)Nc3cc(cc(c3)C(F)(F)F)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzisoxazoles
- Subclass: Benzisoxazolones
- Class: Benzisoxazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6F78 | Download | Experimental | e6f78A1 e6f78B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |