AZ3971

Ligand id: 7804

Name: AZ3971

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 99.17
Molecular weight 422.19
XLogP 3.47
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(5S)-5-(4-methoxy-3,5-dimethylphenyl)-5-(3-pyrimidin-5-ylphenyl)pyrrolo[3,4-b]pyrazin-7-amine
Synonyms
AZ 3971 | AZ-3971
Comments
AZD3971 is an AstraZeneca BACE1 inhibitor. While not published in its own right so far, it has been reported for targeting amyloid beta production in a mouse model of Alzheimer's disease (AD) in combination with the gamma secretase modulator AZ4800 [2].
Database Links
GtoPdb PubChem SID 223366135
PubChem CID 49858172
Search Google for chemical match using the InChIKey BICGYFRWDDPYEI-VWLOTQADSA-N
Search Google for chemicals with the same backbone BICGYFRWDDPYEI
Search UniChem for chemical match using the InChIKey BICGYFRWDDPYEI-VWLOTQADSA-N
Search UniChem for chemicals with the same backbone BICGYFRWDDPYEI