PDB ligand accession: T3J
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: HUEBTMPZBSOCPP-LBPRGKRZSA-N
SMILES: CC(=O)N1CCOC(C1)c2ccc(cc2)F
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 |
---|---|---|---|---|---|
5RER | Download | Experimental | e5rerA1 e5rerA2 | Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel | LigPlot |