Open edwintse opened 5 years ago
Has any progress been made on this - i.e have any compounds been shipped @edwintse
@MFernflower Not yet. Likely in the new year, along with getting the metabolic clearance data for the OHOH compound.
I guess the final list here will depend a little on whether you're going to prioritise the synthesis of further carb acids, right @edwintse i.e. to try to improve potency of the compound that gave super low inhibition (OSM-S-515). Or do you think we should be shipping a set of the above, and then later shipping any other analogs of the carboxylic acid? (link to this discussion installed on wiki).
The methyl and ethyl esters of the acid test perhaps? I do not really know much about the sar of this off target to be honest tho
@edwintse
@mattodd Considering that all the above compounds are in Sydney, I think it would be best to ship them first. The acid derivatives I make here will be shipped separately anyway so better not to wait.
@MFernflower Yes, I was told by someone at a conference who made acid compounds for hERG that esters can help with regaining the potency. I'll try this after I make the rest of the derivatives.
@edwintse Has your ELN changed by any chance? Just curious
Following the hERG results we got for select compounds in April (#37), we will be wanting to run a second round of compounds in preparation for the upcoming paper. This set should consist of:
Are they any other suggestions for compounds to include in this set? There should be a max of 9 compounds that can be run in one well plate.
hERG round 2 chemdraw.zip