PDB ligand accession: S9E
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: UTJFEWWYRZDGSU-UHFFFAOYSA-N
SMILES: c1cc(ncc1C=O)n2ccnc2Br
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridine carboxaldehydes
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7AYF | Download | Experimental | e7ayfA1 | Repetitive alpha hairpins | LigPlot |
7NM9 | Download | Experimental | e7nm9A1 | Repetitive alpha hairpins | LigPlot |