PDB ligand accession: X2V
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XVIQCYUMLUTRMI-UHFFFAOYSA-N
SMILES: c1cc2cc(ccc2c(c1)Oc3ccc(cc3OCCN4C=CC(=O)NC4=O)OS(=O)(=O)F)C#N
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 |
---|---|---|---|---|---|
7KRE | Download | Experimental | e7kreA1 e7kreA4 e7kreB3 | Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits | LigPlot |