PDB ligand accession: VXB
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QOVBXIIYBOEIMU-UHFFFAOYSA-N
SMILES: COCCNC(=O)c1cc(cnc1)Br
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridinecarboxylic acids and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7FNM | Download | Experimental | e7fnmB2 | Repetitive alpha hairpins | LigPlot |