PDB ligand accession: 7IE
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: QOIYTRGFOFZNKF-UHFFFAOYSA-N
SMILES: c1cc(ncc1CN(CC(F)F)C2=CC(=O)OC2)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Halopyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7PDB | Download | Experimental | e7pdbBaB1 e7pdbAaA1 e7pdbBaB1 e7pdbCaC1 e7pdbCaC1 e7pdbDaD1 e7pdbDaD1 e7pdbEaE1 e7pdbAaA1 e7pdbEaE1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |