PDB ligand accession: KRX
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KJXMFUFGGQJXRP-UHFFFAOYSA-N
SMILES: COc1cccc(c1)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 |
---|---|---|---|---|---|
5AIX | Download | Experimental | e5aixB1 e5aixB2 e5aixC1 e5aixC2 | Repetitive alpha hairpins Thioredoxin-like Thioredoxin-like Repetitive alpha hairpins | LigPlot |