1.0 2016-10-03 18:23:36 UTC 2020-05-11 20:49:37 UTC BMDB0011727 BMDB11727 Bicine Bicine buffer Bicene Bis(2-hydroxyethyl)glycine Diethanol glycine Diethylolglycine Dihydroxyethylglycine N,N-(2-Dihydroxyethyl)glycine N,N-(2-Hydroxyethyl)glycine N,N-Bis(2-hydroxyethyl)-glycine N,N-Bis(2-hydroxyethyl)glycine N,N-Bis(2-hydroxyethyl)glycine] N,N-Bis(beta-hydroxyethyl)glycine N,N-Bis(hydroxyethyl)glycine N,N-Di(2-hydroxyethyl)glycine N,N-Dihydroxyethyl glycine N,N-Dihydroxyethylglycine N,N-Bis(2-hydroxyethyl)glycine, monosodium salt N,N-Bis(2-hydroxyethyl)glycine, sodium salt [Bis(2-hydroxyethyl)ammonio]acetic acid BICINE C6H13NO4 163.1717 163.084457909 2-[bis(2-hydroxyethyl)amino]acetic acid bicine 150-25-4 OCCN(CCO)CC(O)=O InChI=1S/C6H13NO4/c8-3-1-7(2-4-9)5-6(10)11/h8-9H,1-5H2,(H,10,11) FSVCELGFZIQNCK-UHFFFAOYSA-N belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Alpha amino acids 1,2-aminoalcohols Amino acids Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Primary alcohols Trialkylamines 1,2-aminoalcohol Alcohol Aliphatic acyclic compound Alkanolamine Alpha-amino acid Amine Amino acid Carbonyl group Carboxylic acid Hydrocarbon derivative Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary alcohol Tertiary aliphatic amine Tertiary amine Aliphatic acyclic compounds bicine Solid logp -1.59 ALOGPS logs 0.05 ALOGPS logp -4.4 ChemAxon pka_strongest_acidic 3.01 ChemAxon pka_strongest_basic 7.66 ChemAxon iupac 2-[bis(2-hydroxyethyl)amino]acetic acid ChemAxon average_mass 163.1717 ChemAxon mono_mass 163.084457909 ChemAxon smiles OCCN(CCO)CC(O)=O ChemAxon formula C6H13NO4 ChemAxon inchi InChI=1S/C6H13NO4/c8-3-1-7(2-4-9)5-6(10)11/h8-9H,1-5H2,(H,10,11) ChemAxon inchikey FSVCELGFZIQNCK-UHFFFAOYSA-N ChemAxon polar_surface_area 81 ChemAxon refractivity 38.66 ChemAxon polarizability 16.3 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 7741 Specdb::CMs 30070 Specdb::CMs 30488 Specdb::CMs 39779 Specdb::CMs 99983 Specdb::CMs 99984 Specdb::CMs 153016 Specdb::MsIr 2590 Specdb::MsIr 2591 Specdb::MsIr 2592 Specdb::MsMs 255675 Specdb::MsMs 255676 Specdb::MsMs 255677 Specdb::MsMs 275616 Specdb::MsMs 275617 Specdb::MsMs 275618 Specdb::MsMs 2246269 Specdb::MsMs 2248003 Specdb::MsMs 2248389 Specdb::MsMs 2250001 Specdb::MsMs 2250417 Specdb::MsMs 2251951 Specdb::MsMs 2775470 Specdb::MsMs 2775471 Specdb::MsMs 2775472 Specdb::MsMs 2907141 Specdb::MsMs 2907142 Specdb::MsMs 2907143 Specdb::NmrOneD 94212 Specdb::NmrOneD 94213 Specdb::NmrOneD 94214 Specdb::NmrOneD 94215 Specdb::NmrOneD 94216 Specdb::NmrOneD 94217 Specdb::NmrOneD 94218 Specdb::NmrOneD 94219 Specdb::NmrOneD 94220 Specdb::NmrOneD 94221 Specdb::NmrOneD 94222 Specdb::NmrOneD 94223 Specdb::NmrOneD 94224 Specdb::NmrOneD 94225 Specdb::NmrOneD 94226 Specdb::NmrOneD 94227 Specdb::NmrOneD 94228 Specdb::NmrOneD 94229 Specdb::NmrOneD 94230 Specdb::NmrOneD 94231 Prostate Tissue Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 FDB028408 8431 8761 39066 C00024831 DB03709 BCN Bicine