PDB ligand accession: 1LI
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RJXIEHBFRZLGTH-IZZNHLLZSA-N
SMILES: CC(=O)NC(Cc1cc(cc(c1)F)F)C(CNC2(CCCCC2)c3cccc(c3)C(C)(C)C)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylbutylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3IVH | Download | Experimental | e3ivhA2 e3ivhA3 | cradle loop barrel cradle loop barrel | LigPlot |