PDB ligand accession: 654
DrugBank: DB03030
PubChem:
ChEMBL:
InChI Key: UMOFOLLUKPBVQG-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)Cn2cc(nc2)c3cccs3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Toluenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1I2Z | Download | Experimental | e1i2zA1 e1i2zB1 | Rossmann-like Rossmann-like | LigPlot |