PDB ligand accession: 3E0
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: RWYMBUBQZGZFES-UHFFFAOYSA-N
SMILES: COc1c(cccc1F)c2csc(n2)N3CCOCC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: Anisoles
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8E1A | Download | Experimental | e8e1aA1 | Nuclear receptor ligand-binding domain | LigPlot |