PDB ligand accession: 896
DrugBank: DB07279
PubChem:
ChEMBL:
InChI Key: JMPSZYHYDMQFEO-KRWDZBQOSA-N
SMILES: CCN(C(C)C)C(=O)c1cc(cc(c1)OCC(C)Nc2ccncc2)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Toluenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2UUJ | Download | Experimental | e2uuj.1 | cradle loop barrel | LigPlot |