PDB ligand accession: KXO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LPUCBGGXXIUBAZ-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)F)c2ccc(cn2)C(=O)NC3CCN(CC3)CC(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3KXO | Download | Experimental | e3kxoA1 e3kxoA2 e3kxoB1 e3kxoB2 | Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like | LigPlot |