PDB ligand accession: 3W9
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MNFZZNNFORDXSV-UHFFFAOYSA-N
SMILES: CCN(CC)c1ccc(cc1)C=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoyl derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4X0U | Download | Experimental | e4x0uA1 e4x0uA2 e4x0uB1 e4x0uB2 e4x0uC1 e4x0uC2 e4x0uD1 e4x0uD2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
4X0T | Download | Experimental | e4x0tA1 e4x0tA2 e4x0tB1 e4x0tB2 e4x0tC1 e4x0tC2 e4x0tD1 e4x0tD2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |