PDB ligand accession: B9C
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZTJQDVXGJTWIGK-UHFFFAOYSA-N
SMILES: CS(=O)(=O)Nc1ccccc1CNc2ccc3c(c2)c(n[nH]3)c4ccc(nc4)N5CCNCC5
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 |
---|---|---|---|---|---|
6J5L | Download | Experimental | e6j5lA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |