CHEMBL4085222
IC50 microM EeAChE 2.13 +/- 0.01; EqBChE 0.021 +/- 0.0005; RatAChE 101 1.8 +/- 0.02; Rat =BChE 8.63 +/- 0.03; HuAChE 3.82 +/- 0.05; HuBChE0.07 +/- 0.01
General
Type : Derivative of Donepezil, Piperidine, Benzylpiperidine, Quinoline, Feruloyl
Chemical_Nomenclature : (E)-1-(4-benzylpiperidin-1-yl)-3-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]-3-methoxyphenyl]prop-2-en-1-one
Canonical SMILES : COC1=C(C=CC(=C1)\/C=C\/C(=O)N2CCC(CC2)CC3=CC=CC=C3)OCCCCN4CCC5=CC=CC=C5C4
InChI : InChI 1S\/C35H42N2O3\/c1-39-34-26-29(14-16-35(38)37-22-17-30(18-23-37)25-28-9-3-2-4-10-28)13-15-33(34)40-24-8-7-20-36-21-19-31-11-5-6-12-32(31)27-36\/h2-6,9-16,26,30H,7-8,17-25,27H2,1H3\/b16-14+
InChIKey : ZWIYUBCAUDUSLA-JQIJEIRASA-N
Other name(s) : BDBM50237374 || EC-7f || Compound 7f
MW : 538.7
Formula : C35H42N2O3
CAS_number :
PubChem : 137648049
UniChem : ZWIYUBCAUDUSLA-JQIJEIRASA-N
Target
Families : CHEMBL4085222 ligand of proteins in family
BCHE
Protein :
human-BCHE
References (1)
| Title : Design, synthesis and evaluation of novel ferulic acid-O-alkylamine derivatives as potential multifunctional agents for the treatment of Alzheimer's disease - Sang_2017_Eur.J.Med.Chem_130_379 |
| Author(s) : Sang Z , Pan W , Wang K , Ma Q , Yu L , Yang Y , Bai P , Leng C , Xu Q , Li X , Tan Z , Liu W |
| Ref : Eur Journal of Medicinal Chemistry , 130 :379 , 2017 |
| Abstract : |
| PubMedSearch : Sang_2017_Eur.J.Med.Chem_130_379 |
| PubMedID: 28279845 |