U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H19FN2O3
Molecular Weight 342.3642
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SEMBRAGILINE

SMILES

CC(=O)N[C@@H]1CN(C(=O)C1)C2=CC=C(OCC3=CC=CC(F)=C3)C=C2

InChI

InChIKey=VMAVCCUQTALHOB-INIZCTEOSA-N
InChI=1S/C19H19FN2O3/c1-13(23)21-16-10-19(24)22(11-16)17-5-7-18(8-6-17)25-12-14-3-2-4-15(20)9-14/h2-9,16H,10-12H2,1H3,(H,21,23)/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H19FN2O3
Molecular Weight 342.3642
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Description

Sembragiline is a potent, selective, long-acting, and reversible monoamine oxidase B (MAO-B) inhibitor developed as a potential treatment for Alzheimer's disease (AD). Sembragiline was involved in phase II clinical trial to evaluate its the safety, tolerability, and efficacy in patients with moderate AD. In addition, the drug was studied for smoking cessation, however, it failed to demonstrate efficacy during a phase II proof-of-concept trial.

Approval Year

PubMed

Sample Use Guides

In Vivo Use Guide
Participants will receive placebo for RO4602522 orally once daily for 12 months.
Route of Administration: Oral
Substance Class Chemical
Record UNII
K3W9672PNJ
Record Status Validated (UNII)
Record Version