PDB ligand accession: 42O
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BMDMKWJIRFLEEY-SFHVURJKSA-N
SMILES: c1ccc2c(c1)cccc2CC3=CC(=O)N4C(CSC4=C3C5CC5)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5F1R | Download | Experimental | e5f1rA1 e5f1rA2 e5f1rA1 e5f1rA2 e5f1rB1 e5f1rB2 | jelly-roll HTH jelly-roll HTH jelly-roll HTH | LigPlot |