SXF3
eqBuChE IC50 = 0.05 +/- 0.003 microM, hBuChE IC50 = 0.04 +/- 0.001 microM, eeAChE IC50 > 100 microM) and selectivity (SI > 2000) toward BuChE
General
Type : Carvacrol-Thymol, Carbamate, Piperidine
Chemical_Nomenclature : 2-isopropyl-5-methylphenol piperidine-1-carboxylate
Canonical SMILES : C1=CC(=CC(=C1C(C)C)OC(N2CCCCC2)=O)C
InChI : InChI=1S\/C16H23NO2\/c1-12(2)14-8-7-13(3)11-15(14)19-16(18)17-9-5-4-6-10-17\/h7-8,11-12H,4-6,9-10H2,1-3H3
InChIKey : DZBAKXJLMCOULM-UHFFFAOYSA-N
Other name(s) :
Target
Families : SXF3 ligand of proteins in family
BCHE
Protein :
human-BCHE
References (1)
| Title : Carvacrol\/thymol derivatives as highly selective BuChE inhibitors with anti-inflammatory activities: Discovery and bio-evaluation - Zhang_2025_Bioorg.Chem_160_108430 |
| Author(s) : Zhang YL , Yang HY , Gou J , Qi XM , Qiao YB , Li QS |
| Ref : Bioorg Chem , 160 :108430 , 2025 |
| Abstract : |
| PubMedSearch : Zhang_2025_Bioorg.Chem_160_108430 |
| PubMedID: 40209354 |