PDB ligand accession: BOJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NVJSDHWZOFXFSJ-UHFFFAOYSA-N
SMILES: CCCc1c(c(nc(n1)N)N)N2CCN(CC2)c3ccccc3
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 |
---|---|---|---|---|---|
6AOI | Download | Experimental | e6aoiA1 e6aoiB2 | Dihydrofolate reductases Dihydrofolate reductases | LigPlot |