PDB ligand accession: VUI
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: JDMAYXLFPMODFC-UHFFFAOYSA-N
SMILES: COCCOc1ccc(cc1N(=O)=O)Br
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 |
---|---|---|---|---|---|
7FME | Download | Experimental | e7fmeB2 | Immunoglobulin-like beta-sandwich | LigPlot |