PDB ligand accession: 1SI
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VDKNIVFIPSLUFD-RGVLZGJSSA-N
SMILES: c1ccnc(c1)Sc2ccc(o2)C=NNC(=O)c3cccc(c3)F
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 |
---|---|---|---|---|---|
7F8H | Download | Experimental | e7f8hB1 e7f8hA1 e7f8hC1 | HAD domain-related HAD domain-related HAD domain-related | LigPlot |