PDB ligand accession: 8NE
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XFLGYXVBXUAGQV-UHFFFAOYSA-O
SMILES: c1cc(ccc1C(=[NH2+])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 |
---|---|---|---|---|---|
5N3D | Download | Experimental | e5n3dA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |