CHEMBL5176915
IC50 = 2.1 +/- 0.1 nM
General
Type : Pyridine, Piperidine, Trifluoro
Chemical_Nomenclature : (2-fluoro-5-hydroxyphenyl)-[4-[[3-[4-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methyl]piperidin-1-yl]methanone
Canonical SMILES : C1CN(CCC1CC2=CC(=CC=C2)OC3=NC=CC(=C3)C(F)(F)F)C(=O)C4=C(C=CC(=C4)O)F
InChI : InChI=1S\/C25H22F4N2O3\/c26-22-5-4-19(32)15-21(22)24(33)31-10-7-16(8-11-31)12-17-2-1-3-20(13-17)34-23-14-18(6-9-30-23)25(27,28)29\/h1-6,9,13-16,32H,7-8,10-12H2
InChIKey : UTKJTDGFBXHMDW-UHFFFAOYSA-N
Other name(s) : BDBM50605682 || MAGL Inhibitor Compound 9 || compound 9
MW : 474.4
Formula : C25H22F4N2O3
CAS_number :
PubChem : 168271680
UniChem : UTKJTDGFBXHMDW-UHFFFAOYSA-N
Target
Families : CHEMBL5176915 ligand of proteins in family
Monoglyceridelipase_lysophospholip
Protein :
human-MGLL
References (1)
| Title : Reversible Monoacylglycerol Lipase Inhibitors: Discovery of a New Class of Benzylpiperidine Derivatives - Bononi_2022_J.Med.Chem__ |
| Author(s) : Bononi G , Di Stefano M , Poli G , Ortore G , Meier P , Masetto F , Caligiuri I , Rizzolio F , Macchia M , Chicca A , Avan A , Giovannetti E , Vagaggini C , Brai A , Dreassi E , Valoti M , Minutolo F , Granchi C , Gertsch J , Tuccinardi T |
| Ref : Journal of Medicinal Chemistry , : , 2022 |
| Abstract : |
| PubMedSearch : Bononi_2022_J.Med.Chem__ |
| PubMedID: 35522977 |