PDB ligand accession: 1SU
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: OJFKUJDRGJSAQB-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)C(F)(F)F)CC(=O)Nc2cc(ccc2F)Oc3ccc4c(c3C#N)sc(n4)NC(=O)C5CC5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6OC1 | Download | Experimental | e6oc1A1 | TIM beta/alpha-barrel | LigPlot |