PDB ligand accession: E4Z
DrugBank: DB15675
PubChem:
ChEMBL:
InChI Key: FIDLLEYNNRGVFR-CTNGQTDRSA-N
SMILES: c1ccc2c(c1)C(c3ccc(c(c3CS2)F)F)N4C5COCCN5C(=O)C6=C(C(=O)C=CN64)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzothiepins
- Subclass: Dibenzothiepins
- Class: Benzothiepins
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6FS8 | Download | Experimental | e6fs8B1 e6fs8A1 | Restriction endonuclease-like Restriction endonuclease-like | LigPlot |
6FS9 | Download | Experimental | e6fs9A1 | Restriction endonuclease-like | LigPlot |