PDB ligand accession: W9I
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QYQLEYTXFMOLEI-UHFFFAOYSA-N
SMILES: c1cc(ncc1Br)NN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: None
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5STM | Download | Experimental | e5stmB1 e5stmB2 | Immunoglobulin-like beta-sandwich Repetitive alpha hairpins | LigPlot |