PDB ligand accession: 1JA
DrugBank: DB00609
PubChem: 3287;2761171;
ChEMBL:
InChI Key: AEOCXXJPGCBFJA-UHFFFAOYSA-N
SMILES: CCc1cc(ccn1)C(=N)S
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: None
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7F72 | Download | Experimental | e7f72A2 e7f72A3 | Bromodomain-like Acyl-CoA dehydrogenase middle domain-like | LigPlot |