PDB ligand accession: 8H0
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: FBHTUGHTOZWUFL-UHFFFAOYSA-N
SMILES: CCCc1cc2cnc(nc2c(c1)OC3CCNCC3)Nc4ccc5cn[nH]c5c4
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 |
---|---|---|---|---|---|
5XY1 | Download | Experimental | e5xy1A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |