PDB ligand accession: VT1
DrugBank: DB13055
PubChem:
ChEMBL:
InChI Key: IDUYJRXRDSPPRC-NRFANRHFSA-N
SMILES: c1cc(ccc1c2ccc(nc2)C(C(Cn3cnnn3)(c4ccc(cc4F)F)O)(F)F)OCC(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 |
---|---|---|---|---|---|
5AJR | Download | Experimental | e5ajrA1 | Cytochrome P450 | LigPlot |