PDB ligand accession: 9RF
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NLJZRFBMZSIDNW-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1OCC(=O)O)SCc2nnc(s2)c3ccc(cc3)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenoxyacetic acid derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6A6P | Download | Experimental | e6a6pA1 e6a6pB1 | Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain | LigPlot |