{"ymdb_id":"YMDB01758","created_at":"2011-08-31T03:42:41.000Z","updated_at":"2016-09-08T18:37:05.000Z","name":"N-Acetyl-L-alanine","cas":"1188-37-0","state":"Solid","melting_point":"199 oC","description":"N-Acetyl-L-alanine is an N-acetyl amino acid.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":"17533","hmdb_id":"HMDB00766","kegg_id":"C00624","pubchem_id":"7345","cs_id":"79449","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(2S)-2-acetamidopropanoic acid","traditional_iupac":"N-acetylalanine","logp":"-0.7598647116666665","pka":"15.629254426140378","alogps_solubility":"4.36e+01 g/l","alogps_logp":"-0.53","alogps_logs":"-0.48","acceptor_count":"3","donor_count":"2","rotatable_bond_count":"2","polar_surface_area":"66.4","refractivity":"29.941100000000006","polarizability":"12.501187655687254","formal_charge":"0","physiological_charge":"-1","pka_strongest_basic":"-1.9647201220572619","pka_strongest_acidic":"3.889227666212694","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["(S)-(-)-N-Acetylalanine","(S)-2-(acetylamino)pentanedioic acid","(S)-N-Acetylalanine","2-Acetylaminopropionic acid","Acetyl-L-alanine","Acetyl-L-glutamic acid","Acetylalanine","acetylglutamic acid","DL-Alanine, N-acetyl-","L-Glutamic acid, N-acetyl-","L-N-Acetylalanine","L-N-acetylglutamic acid","N-Acetyl-(S)-alanine","N-Acetyl-L-glutamate","n-acetyl-l-glutamic acid","N-Acetylalanine","N-Acetylglutamic acid"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":19889834,"citation":"Boer, V. M., Crutchfield, C. A., Bradley, P. H., Botstein, D., Rabinowitz, J. D. (2010). \"Growth-limiting intracellular metabolites in yeast growing under diverse nutrient limitations.\" Mol Biol Cell 21:198-211."},{"pubmed_id":17439666,"citation":"Castrillo, J. I., Zeef, L. A., Hoyle, D. C., Zhang, N., Hayes, A., Gardner, D. C., Cornell, M. J., Petty, J., Hakes, L., Wardleworth, L., Rash, B., Brown, M., Dunn, W. B., Broadhurst, D., O'Donoghue, K., Hester, S. S., Dunkley, T. P., Hart, S. R., Swainston, N., Li, P., Gaskell, S. J., Paton, N. W., Lilley, K. S., Kell, D. B., Oliver, S. G. (2007). \"Growth control of the eukaryote cell: a systems biology study in yeast.\" J Biol 6:4."}],"proteins":[]}