PDB ligand accession: ED8
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FNHUNERGHGEZMB-UHFFFAOYSA-N
SMILES: CN1CCC(CC1)Oc2ccc3c(c2)n(cn3)c4cc(c(s4)C(=O)N)OCc5ccccc5C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Trifluoromethylbenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2XNO | Download | Experimental | e2xnoA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |