PDB ligand accession: A5Q
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: URPRRYYGDXSCNR-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2c(snn2)N)C(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 |
---|---|---|---|---|---|
5ORR | Download | Experimental | e5orrA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |