PDB ligand accession: IM4
DrugBank: DB11421
PubChem: 86418;5538730;5538731;86287518;135527764;135541675;
ChEMBL:
InChI Key: YWTYJOPNNQFBPC-UHFFFAOYSA-N
SMILES: c1cc(ncc1CN2CCNC2=N[N+](=O)[O-])Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Guanidines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3C79 | Download | Experimental | e3c79A1 e3c79E1 e3c79A1 e3c79B1 e3c79B1 e3c79C1 e3c79C1 e3c79D1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |