1.0 2016-09-30 22:43:56 UTC 2020-04-22 15:07:34 UTC BMDB0001310 BMDB01310 D-Alanine (2R)-2-Aminopropanoic acid (R)-2-Aminopropanoic acid (R)-Alanine D-2-Aminopropionic acid D-Ala D-Alanin D-alpha-Alanine D-alpha-Aminopropionic acid DAL (2R)-2-Aminopropanoate (R)-2-Aminopropanoate D-2-Aminopropionate D-a-Alanine D-Α-alanine D-a-Aminopropionate D-a-Aminopropionic acid D-alpha-Aminopropionate D-Α-aminopropionate D-Α-aminopropionic acid Alanine D(-)-a -Alanine D(-)-alpha-Alanine D-(-)-Alanine (2R)-2-Aminopropionic acid (R)-2-Aminopropionic acid D(-)-Α-alanine C3H7NO2 89.0932 89.047678473 (2R)-2-aminopropanoic acid D-alanine 338-69-2 C[C@@H](N)C(O)=O InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1 QNAYBMKLOCPYGJ-UWTATZPHSA-N belongs to the class of organic compounds known as alanine and derivatives. Alanine and derivatives are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Alanine and derivatives Amino acids Carbonyl compounds Carboxylic acids D-alpha-amino acids Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Alanine or derivatives Aliphatic acyclic compound Alpha-amino acid Amine Amino acid Carbonyl group Carboxylic acid D-alpha-amino acid Hydrocarbon derivative Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Aliphatic acyclic compounds D-alpha-amino acid Other amino acids alanine Solid melting_point 292 °C water_solubility 165.0 mg/mL logp -2.912 logp -3.05 ALOGPS logs 0.70 ALOGPS logp -2.8 ChemAxon pka_strongest_acidic 2.47 ChemAxon pka_strongest_basic 9.48 ChemAxon iupac (2R)-2-aminopropanoic acid ChemAxon average_mass 89.0932 ChemAxon mono_mass 89.047678473 ChemAxon smiles C[C@@H](N)C(O)=O ChemAxon formula C3H7NO2 ChemAxon inchi InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1 ChemAxon inchikey QNAYBMKLOCPYGJ-UWTATZPHSA-N ChemAxon polar_surface_area 63.32 ChemAxon refractivity 20.5 ChemAxon polarizability 8.54 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 3 ChemAxon donor_count 2 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 2623 Specdb::CMs 38016 Specdb::CMs 148378 Specdb::NmrTwoD 1620 Specdb::MsMs 1510 Specdb::MsMs 1511 Specdb::MsMs 1512 Specdb::MsMs 5179 Specdb::MsMs 5180 Specdb::MsMs 5181 Specdb::MsMs 5182 Specdb::MsMs 5183 Specdb::MsMs 5184 Specdb::MsMs 5185 Specdb::MsMs 178554 Specdb::MsMs 178555 Specdb::MsMs 178556 Specdb::MsMs 180873 Specdb::MsMs 180874 Specdb::MsMs 180875 Specdb::MsMs 437094 Specdb::MsMs 437095 Specdb::MsMs 440036 Specdb::MsMs 440120 Specdb::MsMs 445521 Specdb::MsMs 445522 Specdb::MsMs 445523 Specdb::MsMs 445524 Specdb::MsMs 445525 Specdb::NmrOneD 1679 Specdb::NmrOneD 5005 Specdb::NmrOneD 147290 Specdb::NmrOneD 147291 Specdb::NmrOneD 147292 Specdb::NmrOneD 147293 Specdb::NmrOneD 147294 Specdb::NmrOneD 147295 Specdb::NmrOneD 147296 Specdb::NmrOneD 147297 Specdb::NmrOneD 147298 Specdb::NmrOneD 147299 Specdb::NmrOneD 147300 Specdb::NmrOneD 147301 Specdb::NmrOneD 147302 Specdb::NmrOneD 147303 Specdb::NmrOneD 147304 Specdb::NmrOneD 147305 Specdb::NmrOneD 147306 Specdb::NmrOneD 147307 Specdb::NmrOneD 147308 Specdb::NmrOneD 147309 FDB022546 C00133 64234 DB01786 71080 15570 C00019654 D-ALANINE 33977 Alanine