PDB ligand accession: O1M
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XARVCWHXIZRCGB-UHFFFAOYSA-N
SMILES: c1cc(ccc1N2CCN(CC2)C(=O)N)F
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 |
---|---|---|---|---|---|
5S5T | Download | Experimental | e5s5tC2 e5s5tB2 | Bacillus chorismate mutase-like Rossmann-like | LigPlot |