PDB ligand accession: 4G3
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WNJXCRUMIMMAQO-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)O)CNc2ccc(cn2)C(=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4YQ4 | Download | Experimental | e4yq4A1 | alpha/beta knot | LigPlot |