1.0 2020-03-10 17:00:37 UTC 2020-04-22 18:55:50 UTC BMDB0096065 BMDB96065 Phenylalanylphenylalanine (2S)-2-{[(2S)-2-amino-3-phenylpropanoyl]amino}-3-phenylpropanoic acid FF H-L-Phe-L-phe-OH H-Phe-phe-OH L-Phe-L-phe (2S)-2-{[(2S)-2-amino-3-phenylpropanoyl]amino}-3-phenylpropanoate (Phenylalanyl)phenylalanine Diphenylalanine F-F Dipeptide FF Dipeptide L,L-Diphenylalanine L-Phe-L-phe-OH L-Phenylalanyl-L-phenylalanine N-L-Phenylalanyl-L-phenylalanine N-Phenylalanylphenylalanine Phe-phe Phenylalanine phenylalanine dipeptide Phenylalanine-phenylalanine dipeptide Phenylalanyl-phenylalanine Phenylalanylphenylalanine C18H20N2O3 312.369 312.147392512 (2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-phenylpropanoic acid (2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-phenylpropanoic acid 2577-40-4 N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O InChI=1S/C18H20N2O3/c19-15(11-13-7-3-1-4-8-13)17(21)20-16(18(22)23)12-14-9-5-2-6-10-14/h1-10,15-16H,11-12,19H2,(H,20,21)(H,22,23)/t15-,16-/m0/s1 GKZIWHRNKRBEOH-HOTGVXAUSA-N belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Dipeptides Alpha amino acid amides Amino acids Amphetamines and derivatives Aralkylamines Carbonyl compounds Carboxylic acid salts Carboxylic acids Fatty amides Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives N-acyl-L-alpha-amino acids Organic oxides Organic salts Organic zwitterions Organopnictogen compounds Phenylalanine and derivatives Phenylpropanoic acids Secondary carboxylic acid amides 3-phenylpropanoic-acid Alpha-amino acid amide Alpha-amino acid or derivatives Alpha-dipeptide Amine Amino acid Amino acid or derivatives Amphetamine or derivatives Aralkylamine Aromatic homomonocyclic compound Benzenoid Carbonyl group Carboxamide group Carboxylic acid Carboxylic acid salt Fatty acyl Fatty amide Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety N-acyl-alpha amino acid or derivatives N-acyl-alpha-amino acid N-acyl-l-alpha-amino acid Organic nitrogen compound Organic oxide Organic oxygen compound Organic salt Organic zwitterion Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylalanine or derivatives Primary aliphatic amine Primary amine Secondary carboxylic acid amide Aromatic homomonocyclic compounds dipeptide logp -0.27 ALOGPS logs -3.86 ALOGPS logp -0.067 ChemAxon pka_strongest_acidic 3.78 ChemAxon pka_strongest_basic 8.01 ChemAxon iupac (2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-phenylpropanoic acid ChemAxon average_mass 312.369 ChemAxon mono_mass 312.147392512 ChemAxon smiles N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O ChemAxon formula C18H20N2O3 ChemAxon inchi InChI=1S/C18H20N2O3/c19-15(11-13-7-3-1-4-8-13)17(21)20-16(18(22)23)12-14-9-5-2-6-10-14/h1-10,15-16H,11-12,19H2,(H,20,21)(H,22,23)/t15-,16-/m0/s1 ChemAxon inchikey GKZIWHRNKRBEOH-HOTGVXAUSA-N ChemAxon polar_surface_area 92.42 ChemAxon refractivity 87.03 ChemAxon polarizability 33.56 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 133870 Specdb::CMs 141604 Specdb::MsMs 2426140 Specdb::MsMs 2426141 Specdb::MsMs 2426142 Specdb::MsMs 2509687 Specdb::MsMs 2509688 Specdb::MsMs 2509689 Specdb::NmrOneD 152190 Specdb::NmrOneD 152191 Specdb::NmrOneD 152192 Specdb::NmrOneD 152193 Specdb::NmrOneD 152194 Specdb::NmrOneD 152195 Specdb::NmrOneD 152196 Specdb::NmrOneD 152197 Specdb::NmrOneD 152198 Specdb::NmrOneD 152199 Specdb::NmrOneD 152200 Specdb::NmrOneD 152201 Specdb::NmrOneD 152202 Specdb::NmrOneD 152203 Specdb::NmrOneD 152204 Specdb::NmrOneD 152205 Specdb::NmrOneD 152206 Specdb::NmrOneD 152207 Specdb::NmrOneD 152208 Specdb::NmrOneD 152209 FDB029369 5361193 6993089 72723