PDB ligand accession: 3SN
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PIGCNHMXDYACOO-UHFFFAOYSA-N
SMILES: CC(=O)N1CCN(CC1)c2ccc(c(c2)F)CN(C3CCC3)S(=O)(=O)c4ccccc4
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 |
---|---|---|---|---|---|
4WPF | Download | Experimental | e4wpfA1 e4wpfD1 | Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain | LigPlot |