PDB ligand accession: 1K3
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: DPVQBIWIVWTDRV-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)c2ccc(cc2)Nc3nc4cccc(n4n3)c5ccc(cc5)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazinanes
- Subclass: Piperazines
- Class: Diazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4JIA | Download | Experimental | e4jiaA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |