PDB ligand accession: 3EA
DrugBank: DB07053
PubChem:
ChEMBL:
InChI Key: TWVYNPULGKGJOS-UHFFFAOYSA-N
SMILES: CCCc1c(ccc2c1onc2C(F)(F)F)OCCCOc3ccc4c(c3)ccn4CC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolyl carboxylic acids and derivatives
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2ATH | Download | Experimental | e2athA1 e2athB1 | Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain | LigPlot |