PDB ligand accession: K9S
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WHTPXNOFEHTZAD-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)c(cs2)CN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzothiophenes
- Subclass: 1-benzothiophenes
- Class: Benzothiophenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4ABB | Download | Experimental | e4abbA1 | cradle loop barrel | LigPlot |