PDB ligand accession: JT2
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QYPDCDACLUDSPR-ZETCQYMHSA-N
SMILES: CC(CN)Nc1cc(cc2c1cc(s2)C(=N)N)CS
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 |
---|---|---|---|---|---|
6RJQ | Download | Experimental | e6rjqA1 | Repetitive alpha hairpins | LigPlot |
6R5L | Download | Experimental | e6r5lA1 | Repetitive alpha hairpins | LigPlot |