PDB ligand accession: 16J
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KDSIRFZJOTZBPT-UHFFFAOYSA-N
SMILES: c1cc(ccc1N2CCN(CC2)C(=O)N3CCOCC3)Cl
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 |
---|---|---|---|---|---|
4HMN | Download | Experimental | e4hmnA1 | TIM beta/alpha-barrel | LigPlot |