PDB ligand accession: 3DE
DrugBank: DB07051
PubChem:
ChEMBL: n/a
InChI Key: BUIZDUYEIRRDAV-UHFFFAOYSA-O
SMILES: CCOC(=O)c1c([nH+]n(c1C)c2ccccc2)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1Y2C | Download | Experimental | e1y2cA1 e1y2cB1 | PDEase-like PDEase-like | LigPlot |