CHEMBL3818053
AChE IC50 0.036 microM; BCHE IC50 2.778 microM; Abeta inhibition IC50 10.11 microM; ORAC 2.84 microM trolox equivalent'
General
Type : Pyrimidine, Piperazine, Inden
Chemical_Nomenclature : 2-[[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methylidene]indene-1,3-dione
Canonical SMILES : C1CN(CCN1C2=CC=C(C=C2)C=C3C(=O)C4=CC=CC=C4C3=O)C5=NC=CC=N5
InChI : InChI=1S\/C24H20N4O2\/c29-22-19-4-1-2-5-20(19)23(30)21(22)16-17-6-8-18(9-7-17)27-12-14-28(15-13-27)24-25-10-3-11-26-24\/h1-11,16H,12-15H
InChIKey : BALUHLXDWKRXCC-UHFFFAOYSA-N
Other name(s) : BDBM50183044 || Compound 38
MW : 396.4
Formula : C24H20N4O2
CAS_number :
PubChem : 127048771
UniChem : BALUHLXDWKRXCC-UHFFFAOYSA-N
Target
Families : CHEMBL3818053 ligand of proteins in family
ACHE
Protein :
human-ACHE
References (1)
| Title : Design, synthesis and evaluation of novel indandione derivatives as multifunctional agents with cholinesterase inhibition, anti-beta-amyloid aggregation, antioxidant and neuroprotection properties against Alzheimer's disease - Mishra_2016_Bioorg.Med.Chem_24_3829 |
| Author(s) : Mishra CB , Manral A , Kumari S , Saini V , Tiwari M |
| Ref : Bioorganic & Medicinal Chemistry , 24 :3829 , 2016 |
| Abstract : |
| PubMedSearch : Mishra_2016_Bioorg.Med.Chem_24_3829 |
| PubMedID: 27353888 |