PDB ligand accession: MDW
DrugBank: DB08170
PubChem:
ChEMBL: n/a
InChI Key: AYFCYVLVRYQGME-QGZVFWFLSA-N
SMILES: COc1ccc(cc1)S(=O)(=O)N2CCc3cc(c(cc3C2C(=O)NO)OC)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Tetrahydroisoquinolines
- Subclass: None
- Class: Tetrahydroisoquinolines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2DDY | Download | Experimental | e2ddyA1 | Zincin-like | LigPlot |