Methyl (2S)-2-{[1-(b...
Vérifier sur isomerdesign
Data
InChI: InChI=1S/C19H25N3O3/c1-6-7-12-22-14-11-9-8-10-13(14)15(21-22)17(23)20-16(18(24)25-5)19(2,3)4/h6,8-11,16H,1,7,12H2,2-5H3,(H,20,23)
Synonymes: MDMB-3en-BUTINACA,Methyl 2-(((1-(but-3-en-1-yl)-1H-indazol-3-yl)carbonyl)amino)-3,3-dimethylbutanoate,Methyl N-[1-(but-3-en-1-yl)-1H-indazole-3-carbonyl]-3-methyl-L-valinate,Methyl (2S)-2-{[1-(but-3-en-1-yl)-1H-indazole-3-carbonyl]amino}-3,3-dimethylbutanoate
Estimated data
Solubility: -3.91 (log(S) in mol/L prediction using SolTranNet)
Blood Brain Barrier Permeability: Yes (prediction using frontiersin.org)
Addictivity Prediction: 96.5% (prediction based on www.mdpi.com)