PDB ligand accession: 47M
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: MMOMFJIMQXUJMQ-UHFFFAOYSA-N
SMILES: c1cc(oc1CN)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Amines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4Y5A | Download | Experimental | e4y5aA1 e4y5aA2 | cradle loop barrel cradle loop barrel | LigPlot |