PDB ligand accession: 0CB
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: NPBKHEMDWREFJJ-MTDXEUNCSA-N
SMILES: CC(=N)N1CCC(CC1)Oc2ccc(cc2)N(Cc3ccc4ccc(cc4c3)C(=N)N)S(=O)(=O)CC(=O)O
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 |
---|---|---|---|---|---|
3UUZ | Download | Experimental | e3uuzA1 e3uuzB1 | cradle loop barrel cradle loop barrel | LigPlot |