PDB ligand accession: 5EL
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FEOIBPWKGPFSTB-NDEPHWFRSA-N
SMILES: c1cc(ccc1C#CC2(CN3CCC2CC3)O)Oc4ccc(cc4)C(=O)NCc5ccncc5
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 |
---|---|---|---|---|---|
2YIG | Download | Experimental | e2yigA1 e2yigB1 | Zincin-like Zincin-like | LigPlot |