PDB ligand accession: AX5
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ATPMWVFWJFZLJM-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CSc2cc(nc(n2)N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organosulfur compounds
- Class: Thioethers
- Subclass: Aryl thioethers
- Class: Thioethers
- Superclass: Organosulfur compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3BMQ | Download | Experimental | e3bmqA1 e3bmqB1 e3bmqC1 e3bmqD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |