PDB ligand accession: QFC
DrugBank: DB17584
PubChem:
ChEMBL:
InChI Key: YTINZZFBHWSAGL-NDEPHWFRSA-N
SMILES: c1cc2c(c(c1)OCc3ccc(cc3)CN4CCN(CC4)c5ccc(cc5F)C#N)CN(C2=O)C6CCC(=O)NC6=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazinanes
- Subclass: Piperazines
- Class: Diazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8D7W | Download | Experimental | e8d7wB1 e8d7wB2 | ETN0001 domain-like cradle loop barrel | LigPlot |
8D7Z | Download | Experimental | e8d7zB1 e8d7zB2 e8d7zC1 | cradle loop barrel ETN0001 domain-like beta-beta-alpha zinc fingers | LigPlot |
8D7V | Download | Experimental | e8d7vB1 e8d7vB2 | cradle loop barrel ETN0001 domain-like | LigPlot |
8D7U | Download | Experimental | e8d7uB1 e8d7uB2 | ETN0001 domain-like cradle loop barrel | LigPlot |