PDB ligand accession: R66
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YJEUVMCEEMSKGZ-LJQANCHMSA-N
SMILES: c1ccc2c(c1)cncc2N3CCC(C3=O)(c4cccc(c4)Cl)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrrolidines
- Subclass: Phenylpyrrolidines
- Class: Pyrrolidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7GL6 | Download | Experimental | e7gl6A1 e7gl6A2 e7gl6B1 e7gl6A2 e7gl6B1 e7gl6B2 | Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |