PDB ligand accession: 19K
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MYHBMTAGTIOCHM-UHFFFAOYSA-N
SMILES: Cc1c(sc(n1)C)c2ccnc(n2)Nc3ccc(c(c3)[N+](=O)[O-])N(C)C
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 |
---|---|---|---|---|---|
3SW7 | Download | Experimental | e3sw7A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |