PDB ligand accession: ORG
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZBLLHXCRPWKVCY-UHFFFAOYSA-N
SMILES: C1CCC(CC1)Nc2nc(nc(n2)N3CCNCC3)C#N
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 |
---|---|---|---|---|---|
3KW9 | Download | Experimental | e3kw9A1 | Cysteine proteinases-like | LigPlot |