PDB ligand accession: B5O
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: PDEIRWICIYOXPB-CYBMUJFWSA-N
SMILES: CC(C)C1Cc2c(nnn2c3cc(c(c(c3)F)c4cc(ccc4F)CO)F)C(=O)C1
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Biphenyls and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6J3B | Download | Experimental | e6j3bA1 | TIM beta/alpha-barrel | LigPlot |