PDB ligand accession: ZMG
DrugBank: DB08771
PubChem: 23644575;135566336;
ChEMBL:
InChI Key: OJJBBNIYQKFZDK-SNVBAGLBSA-N
SMILES: CC(C)C1C(=O)N=C(S1)Nc2ccccc2F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Aniline and substituted anilines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2RBE | Download | Experimental | e2rbeA1 e2rbeB1 e2rbeC1 e2rbeD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |