PDB ligand accession: 7RF
DrugBank: DB12598
PubChem:
ChEMBL:
InChI Key: MQQNFDZXWVTQEH-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(=O)Oc2ccc3cc(ccc3c2)C(=N)N)NC(=N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7VM7 | Download | Experimental | e7vm7U1 | cradle loop barrel | LigPlot |