PDB ligand accession: 4TX
DrugBank: DB01241
PubChem:
ChEMBL:
InChI Key: HEMJJKBWTPKOJG-UHFFFAOYSA-N
SMILES: Cc1ccc(c(c1)OCCCC(C)(C)C(=O)O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5BOJ | Download | Experimental | e5bojA1 e5bojB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |