PDB ligand accession: XI1
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: AMFHXCAGSKYZAM-XYPYZODXSA-N
SMILES: c1cc(c(cc1OC2CCC(CC2)NS(=O)(=O)C(F)(F)F)Cl)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5A5I | Download | Experimental | e5a5iA1 | Cytochrome P450 | LigPlot |