PDB ligand accession: IAQ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YMSXHRWUGLAAKL-YFHOEESVSA-N
SMILES: Cc1ccccc1Nc2c3cncn3c4cc(c(cc4n2)F)N(C)C(=O)C=CCN(C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3T9T | Download | Experimental | e3t9tA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |