PDB ligand accession: UI2
DrugBank: DB04059
PubChem:
ChEMBL:
InChI Key: GRQLDCHTDNYVQI-UHFFFAOYSA-N
SMILES: c1cc2ccc(cc2c(c1)Nc3ncccn3)C(=N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1SQO | Download | Experimental | e1sqoA1 | cradle loop barrel | LigPlot |