PDB ligand accession: WH1
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: ODNBJUNZVHSOQB-UHFFFAOYSA-N
SMILES: CN(CCc1ccccn1)C(=O)c2ccccc2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5SM1 | Download | Experimental | e5sm1D2 | Rossmann-like | LigPlot |