PDB ligand accession: 3BN
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WCVRLSCSQDAERN-RRPNLBNLSA-N
SMILES: CN(c1cc(cc(c1)C(=O)NC(Cc2ccccc2)C(CNC3CC3)O)C(=O)c4ccccc4)S(=O)(=O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzophenones
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2B8V | Download | Experimental | e2b8vA2 e2b8vA3 | cradle loop barrel cradle loop barrel | LigPlot |