PDB ligand accession: 0SZ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZGVIUMKHTXKKOX-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)CCN(C2)S(=O)(=O)c3cccc(c3)C(=O)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 |
---|---|---|---|---|---|
4FAM | Download | Experimental | e4famA1 e4famB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |