PDB ligand accession: NQS
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: IBLOZMPODBITIK-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(=O)C=C(C2=O)SCCO
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: Naphthoquinones
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4PE0 | Download | Experimental | e4pe0X1 e4pe0A1 | EF-hand EF-hand | LigPlot |