PDB ligand accession: IM9
DrugBank: DB07982
PubChem:
ChEMBL:
InChI Key: PVTKDXZNSUHUMO-UHFFFAOYSA-N
SMILES: Cc1ncc(n1C(C)C)c2ccnc(n2)Nc3ccc(cc3)N4CCN(CC4)C(=O)CO
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 |
---|---|---|---|---|---|
2VV9 | Download | Experimental | e2vv9A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |