PDB ligand accession: TMJ
DrugBank: DB08631
PubChem:
ChEMBL:
InChI Key: UVSIFVBCHJEYJP-UHFFFAOYSA-N
SMILES: c1cc(ccc1NS(=O)(=O)c2ccc3c(c2)CNCC3)Cl
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 |
---|---|---|---|---|---|
2ONY | Download | Experimental | e2onyA1 | Rossmann-like | LigPlot |
2ONZ | Download | Experimental | e2onzA1 e2onzB1 | Rossmann-like Rossmann-like | LigPlot |