PDB ligand accession: DF6
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BRXZUOJFGVQTAB-UHFFFAOYSA-N
SMILES: COc1cc2c(ccnc2cc1OC)Oc3ccc(cc3)NC(=S)NC(=O)Cc4ccccc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: N-phenylthioureas
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3VW8 | Download | Experimental | e3vw8A2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |