Stimulants Deconstructed Aminorex - linear DiAmines (amphetaDiAmines)

[LikeADaVinci]

Hi, I’m new here, but I’ve been studying receptor theory, structure activity relationships, molecular docking theory & etc for almost twenty years.

I wanted to propose a few new amphetamine analogues for you all to consider (and possibly synthesize and try out if you have the time & ability)

They are both derived from aminorex, I call them amphetaDiAmines since there are two amines:








Since aminorex contains two amines, I have deconstructed the ring structure to lay out the amines linearly

Can anyone put these chemicals into software to guess the monoaminergic activity for binding affinities of NA, DA, & 5-HT?

Please let me know what you think, bluelighters!

 

[shapeshifter32]

You're probably already aware of BindingDB. But if not...

Binding Database Home

BindingDB Data

www.bindingdb.org

 

[shapeshifter32]

The Bees over at the vespiary probably know about this

 

[Didgital]

Can anyone put these chemicals into software to guess the monoaminergic activity for binding affinities of NA, DA, 5HT

SwissTargetPrediction

www.swisstargetprediction.ch

I plugged the 1st compound in and it doesn't look promising.

 

[LucidSDreamr]

Post this in the neuroscience and pharmacology sub forum it is mor appropriate for that type of discussion.

Wild guess but I don’t think the 2nd one is active being a homologue.