PDB ligand accession: MES
DrugBank: DB03814
PubChem: 78165;4478249;
ChEMBL:
InChI Key: SXGZJKUKBWWHRA-UHFFFAOYSA-N
SMILES: C1COCC[NH+]1CCS(=O)(=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Oxazinanes
- Subclass: Morpholines
- Class: Oxazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4QKZ | Download | Experimental | e4qkzA1 | Zincin-like | LigPlot |
3TT4 | Download | Experimental | e3tt4A1 | Zincin-like | LigPlot |
1ZS0 | Download | Experimental | e1zs0A1 | Zincin-like | LigPlot |
5H8X | Download | Experimental | e5h8xA1 | Zincin-like | LigPlot |