PDB ligand accession: 7N1
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RQCNWTHUESPRKJ-UHFFFAOYSA-N
SMILES: c1cc2c(cc1C#N)cc(cc2Oc3ccc(cc3OCCN4C=CC(=O)NC4=O)F)F
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 |
---|---|---|---|---|---|
5TW3 | Download | Experimental | e5tw3A2 e5tw3A4 | Ribonuclease H-like Alpha-beta plaits | LigPlot |