PDB ligand accession: 4AV
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YRTNCUPHKWUHMQ-UHFFFAOYSA-N
SMILES: CNCc1cc(ccc1Cl)[N+](=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Nitrobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5MB7 | Download | Experimental | e5mb7A1 e5mb7A2 | cradle loop barrel cradle loop barrel | LigPlot |
4YD5 | Download | Experimental | e4yd5A1 e4yd5A2 | cradle loop barrel cradle loop barrel | LigPlot |