PDB ligand accession: UQW
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: UWYXREXKBLOKIU-OAHLLOKOSA-N
SMILES: CCC(C(=O)NCCc1c[nH]c2c1cccc2)OC(=O)C=C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7NT1 | Download | Experimental | e7nt1A2 e7nt1B1 e7nt1B2 | cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain | LigPlot |