PDB ligand accession: JA3
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BJEMGBNLIALWCL-UHFFFAOYSA-N
SMILES: CCc1cc(c(cc1F)Oc2cccnc2F)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4D44 | Download | Experimental | e4d44A1 e4d44B1 e4d44D1 e4d44F1 e4d44H1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |