PDB ligand accession: MZ3
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: AXUYLLZCOSCKTG-URLMMPGGSA-N
SMILES: Cc1c(cccc1F)C(=O)NC(Cc2ccccc2)C(CN(Cc3cccs3)S(=O)(=O)c4cccc(c4)OC)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylbutylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2QI0 | Download | Experimental | e2qi0A1 e2qi0B1 | cradle loop barrel cradle loop barrel | LigPlot |