SCHEMBL31549744

IC50 human-MGLL 0.72nM

General

Type : Trifluoro, Azaspiro, Urea derivative, Sulfur Compound

Chemical_Nomenclature : (6,6-dioxo-6lambda6-thia-2,5-diazaspiro[3.4]octan-2-yl)-[6-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-azaspiro[3.3]heptan-2-yl]methanone

Canonical SMILES : C1CS(=O)(=O)NC12CN(C2)C(=O)N3CC4(C3)CC(C4)CC5=C(C=C(C=C5)C(F)(F)F)F

InChI : InChI=1S\/C20H23F4N3O3S\/c21-16-6-15(20(22,23)24)2-1-14(16)5-13-7-18(8-13)9-26(10-18)17(28)27-11-19(12-27)3-4-31(29,30)25-19\/h1-2,6,13,25H,3-5,7-12H2

InChIKey : PWHWNZXTPWGWOP-UHFFFAOYSA-N

Other name(s) : Compound 61  ||  2-[(6-{[2-Fluoro-4-(trifluoromethyl)phenyl]methyl}-2-aza-2-spiro[3.3]heptyl)carbonyl]-6lambda6-thia-2,5-diaza-6,6-spiro[3.4]octanedione


MW : 461.5

Formula : C20H23F4N3O3S

CAS_number :

PubChem : 176336573

UniChem : PWHWNZXTPWGWOP-UHFFFAOYSA-N

Target

Families : SCHEMBL31549744 ligand of proteins in family
Monoglyceridelipase_lysophospholip

Protein :
human-MGLL

References (1)

Title : Novel Substituted Spiro-Ureas as Monoacylglycerol Lipase Inhibitors - Rong_2026_ACS.Med.Chem.Lett_17_54
Author(s) : Rong J , Liang SH
Ref : ACS Med Chem Lett , 17 :54 , 2026
Abstract :
PubMedSearch : Rong_2026_ACS.Med.Chem.Lett_17_54
PubMedID: 41531966