PDB ligand accession: 3R5
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GXQNKVDAAINMNE-UHFFFAOYSA-N
SMILES: COc1ccc(c(c1)C=O)OCc2cccnc2
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 |
---|---|---|---|---|---|
3R5I | Download | Experimental | e3r5iA1 e3r5iA1 e3r5iC1 | Globin-like Globin-like Globin-like | LigPlot |