PDB ligand accession: 6T5
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SRUWPAISQUBIOQ-UHFFFAOYSA-N
SMILES: CC1=NNC(=O)N=C1Nc2ccc(cc2)C(C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Cumenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5R9T | Download | Experimental | e5r9tA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |