PDB ligand accession: XT3
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: IXUICFFBXXUCFL-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)C#N)Oc2ccc(cc2O)Cn3cc(nn3)C4CCCCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Diphenylethers
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5MTQ | Download | Experimental | e5mtqA1 e5mtqE1 e5mtqB1 e5mtqG1 e5mtqC1 e5mtqF1 e5mtqD1 e5mtqH1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |