PDB ligand accession: 4CF
DrugBank: n/a
PubChem: 1501865;7128311;
ChEMBL: n/a
InChI Key: KWIPUXXIFQQMKN-VIFPVBQESA-N
SMILES: c1cc(ccc1CC(C(=O)O)N)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- 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 |
---|---|---|---|---|---|
7ZVV | Download | Experimental | e7zvvB1 | cradle loop barrel | LigPlot |