PDB ligand accession: H06
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: DDBLYJHCQJAIJN-QGMBQPNBSA-N
SMILES: c1cc(cnc1)C(=O)NN=Cc2ccc(cc2)C(=N)N
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 |
---|---|---|---|---|---|
3A88 | Download | Experimental | e3a88A1 | cradle loop barrel | LigPlot |
3A87 | Download | Experimental | e3a87A1 | cradle loop barrel | LigPlot |
3A83 | Download | Experimental | e3a83A1 | cradle loop barrel | LigPlot |
3A89 | Download | Experimental | e3a89A1 | cradle loop barrel | LigPlot |
3A81 | Download | Experimental | e3a81A1 | cradle loop barrel | LigPlot |