5ZUN-3l
General
Type : Pyrrolidine,Piperazine,Sulfur Compound
Chemical_Nomenclature : 1-[3-(2-chlorophenyl)phenyl]-4-[4-(1,3-thiazole-2-carbonyl)piperazin-1-yl]pyrrolidin-2-one
Canonical SMILES : C1CN(CCN1C2CC(=O)N(C2)C3=CC=CC(=C3)C4=CC=CC=C4Cl)C(=O)C5=NC=CS5
InChI : InChI=1S\/C24H23ClN4O2S\/c25-21-7-2-1-6-20(21)17-4-3-5-18(14-17)29-16-19(15-22(29)30)27-9-11-28(12-10-27)24(31)23-26-8-13-32-23\/h1-8,13-14,19H,9-12,15-16H2
InChIKey : OFKDHTKARMXLGB-UHFFFAOYSA-N
Other name(s) : SCHEMBL18187622,CHEMBL4204645,BDBM50459632,9JX
MW : 466.98
Formula : C24H23ClN4O2S
CAS_number :
PubChem : 122653897
UniChem : OFKDHTKARMXLGB-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : 5ZUN-3l ligand of proteins in family: Monoglyceridelipase_lysophospholip
Stucture : 5ZUN Crystal structure of human monoacylglycerol lipase in complex with compound 3l
Protein : human-MGLL
References (1)
| Title : Design, Synthesis, and Evaluation of Piperazinyl Pyrrolidin-2-ones as a Novel Series of Reversible Monoacylglycerol Lipase Inhibitors - Aida_2018_J.Med.Chem_61_9205 |
| Author(s) : Aida J , Fushimi M , Kusumoto T , Sugiyama H , Arimura N , Ikeda S , Sasaki M , Sogabe S , Aoyama K , Koike T |
| Ref : Journal of Medicinal Chemistry , 61 :9205 , 2018 |
| Abstract : Aida_2018_J.Med.Chem_61_9205 |
| ESTHER : Aida_2018_J.Med.Chem_61_9205 |
| PubMedSearch : Aida_2018_J.Med.Chem_61_9205 |
| PubMedID: 30251836 |
| Gene_locus related to this paper: human-MGLL |