PDB ligand accession: I15
DrugBank: DB07935
PubChem:
ChEMBL:
InChI Key: JYAHFMKZJRVTDT-UHFFFAOYSA-N
SMILES: Cc1c2c(ccc(c2Oc3cc(cc(c3)C#N)C#N)F)[nH]n1
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 |
---|---|---|---|---|---|
2JLE | Download | Experimental | e2jleA5 e2jleA7 | Ribonuclease H-like Alpha-beta plaits | LigPlot |