PDB ligand accession: OAJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: AJUGJYIFDAVOIF-LJQANCHMSA-N
SMILES: Cc1cc(ccc1C#N)Oc2ccc(cc2)CC(=O)N3CCOCC3C(=O)O
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 |
---|---|---|---|---|---|
6PD7 | Download | Experimental | e6pd7A1 e6pd7B1 e6pd7B2 | Thioredoxin-like Thioredoxin-like Insertion subdomain in DsbA-like | LigPlot |
6PGJ | Download | Experimental | e6pgjA1 e6pgjB2 | Insertion subdomain in DsbA-like Thioredoxin-like | LigPlot |