5F-EMB-PICA
Vérifier sur isomerdesign
Data
InChI: InChI=1S/C21H29FN2O3/c1-4-27-21(26)19(15(2)3)23-20(25)17-14-24(13-9-5-8-12-22)18-11-7-6-10-16(17)18/h6-7,10-11,14-15,19H,4-5,8-9,12-13H2,1-3H3,(H,23,25)
Synonymes: Ethyl N-[1-(5-fluoropentyl)-1H-indole-3-carbonyl]-L-valinate,5-fluoro EMB-PICA,5F-EMB-PICA,Ethyl 2-[[1-(5-Fluoropentyl)indole-3-carbonyl]amino]-3-methylbutanoate,Ethyl (2S)-2-([1-(5-fluoropentyl)-1H-indole-3-carbonyl]amino)-3-methylbutanoate,EMB-5F-PICA
Estimated data
Solubility: -4.889 (log(S) in mol/L prediction using SolTranNet)
Blood Brain Barrier Permeability: Yes (prediction using frontiersin.org)
Addictivity Prediction: 65.6% (prediction based on www.mdpi.com)