PDB ligand accession: 24V
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MCPPMOSBWNMSOA-UHFFFAOYSA-N
SMILES: c1cc(ncc1N2CCNCC2)Nc3ncc4c5ccncc5n(c4n3)C6CCCC6
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 |
---|---|---|---|---|---|
4TTH | Download | Experimental | e4tthB1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |