PDB ligand accession: O3R
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: UMTNBAIWJVAAGI-UHFFFAOYSA-N
SMILES: CN(Cc1ccc(c(c1)Cl)Cl)c2ccc(cn2)S(=O)(=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5SML | Download | Experimental | e5smlA1 e5smlA2 | cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |