PDB ligand accession: 69Y
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: IBVDSAFESRHIBV-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C2=NOC3(C2)CCN(CC3)C(=O)CCC(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azaspirodecane derivatives
- Subclass: None
- Class: Azaspirodecane derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5N7O | Download | Experimental | e5n7oA1 e5n7oA2 e5n7oB1 e5n7oB1 e5n7oB2 | Tetracyclin repressor-like, C-terminal domain HTH Tetracyclin repressor-like, C-terminal domain Tetracyclin repressor-like, C-terminal domain HTH | LigPlot |
5ICJ | Download | Experimental | e5icjA1 e5icjA2 e5icjB1 e5icjB2 | HTH Tetracyclin repressor-like, C-terminal domain Tetracyclin repressor-like, C-terminal domain HTH | LigPlot |