PDB ligand accession: 1QB
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: KSMIDXVYBNGOED-UHFFFAOYSA-N
SMILES: CC(=O)NC1=CCC2=C(C1)CC=C2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Carboxylic acid derivatives
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4KAD | Download | Experimental | e4kadA2 e4kadB2 | Rossmann-like Rossmann-like | LigPlot |