CHEMBL3793506
General
Type : Trifluoro,Cyanide,Pyrimidine,Morpholine
Chemical_Nomenclature : 2-[4-chloro-3-(trifluoromethyl)phenoxy]-5-[(1-methyl-6-morpholin-4-yl-2-oxopyrimidin-4-yl)oxymethyl]benzonitrile
Canonical SMILES : CN1C(=CC(=NC1=O)OCC2=CC(=C(C=C2)OC3=CC(=C(C=C3)Cl)C(F)(F)F)C#N)N4CCOCC4
InChI : InChI=1S\/C24H20ClF3N4O4\/c1-31-22(32-6-8-34-9-7-32)12-21(30-23(31)33)35-14-15-2-5-20(16(10-15)13-29)36-17-3-4-19(25)18(11-17)24(26,27)28\/h2-5,10-12H,6-9,14H2,1H3
InChIKey : PMEUVHXCUQCPNX-UHFFFAOYSA-N
Other name(s) : 4-[4-[3-(Trifluoromethyl)-4-chlorophenoxy]-3-cyanobenzyloxy]-6-morpholino-1-methylpyrimidine-2(1H)-one,SCHEMBL17884191,BDBM50162271,J3.621.108C,Compound 14c
MW : 520.9
Formula : C24H20ClF3N4O4
CAS_number :
PubChem : 121448374
UniChem : PMEUVHXCUQCPNX-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : CHEMBL3793506 ligand of proteins in family: PAF-Acetylhydrolase
Stucture :
Protein : human-PLA2G7
References (1)
| Title : Discovery of Potent and Orally Active Lipoprotein-Associated Phospholipase A2 (Lp-PLA2) Inhibitors as a Potential Therapy for Diabetic Macular Edema - Chen_2016_J.Med.Chem_59_2674 |
| Author(s) : Chen X , Wang K , Xu W , Ma Q , Chen M , Du L , Mo M , Wang Y , Shen J |
| Ref : Journal of Medicinal Chemistry , 59 :2674 , 2016 |
| Abstract : Chen_2016_J.Med.Chem_59_2674 |
| ESTHER : Chen_2016_J.Med.Chem_59_2674 |
| PubMedSearch : Chen_2016_J.Med.Chem_59_2674 |
| PubMedID: 26927682 |
| Gene_locus related to this paper: human-PLA2G7 |