1.0 2020-03-03 19:26:26 UTC 2020-04-22 15:55:32 UTC BMDB0063854 BMDB63854 Glutaminylhydroxyproline Glutamine hydroxyproline dipeptide GLN-HPro Glutamine-hydroxyproline dipeptide L-Glutaminyl-L-hydroxyproline Q-HP Dipeptide QHP Dipeptide GLN-Hyp Glutaminyl-hydroxyproline L-GLN-L-Hyp (2S,4R)-1-[(2S)-2-Amino-4-(C-hydroxycarbonimidoyl)butanoyl]-4-hydroxypyrrolidine-2-carboxylate Glutaminylhydroxyproline C10H17N3O5 259.262 259.116820659 (2S,4R)-1-[(2S)-2-amino-4-carbamoylbutanoyl]-4-hydroxypyrrolidine-2-carboxylic acid (2S,4R)-1-[(2S)-2-amino-4-carbamoylbutanoyl]-4-hydroxypyrrolidine-2-carboxylic acid N[C@@H](CCC(N)=O)C(=O)N1C[C@H](O)C[C@H]1C(O)=O InChI=1S/C10H17N3O5/c11-6(1-2-8(12)15)9(16)13-4-5(14)3-7(13)10(17)18/h5-7,14H,1-4,11H2,(H2,12,15)(H,17,18)/t5-,6+,7+/m1/s1 HNXKAWFNQGNMNH-VQVTYTSYSA-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 Azacyclic compounds Carbonyl compounds Carboxylic acids Fatty amides Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives N-acyl-L-alpha-amino acids N-acylpyrrolidines Organic oxides Organopnictogen compounds Primary carboxylic acid amides Proline and derivatives Pyrrolidine carboxylic acids Secondary alcohols Tertiary carboxylic acid amides Alcohol Aliphatic heteromonocyclic compound Alpha-amino acid amide Alpha-amino acid or derivatives Alpha-dipeptide Amine Amino acid Amino acid or derivatives Azacycle Carbonyl group Carboxamide group Carboxylic acid Fatty acyl Fatty amide Hydrocarbon derivative Monocarboxylic acid or derivatives N-acyl-alpha amino acid or derivatives N-acyl-alpha-amino acid N-acyl-l-alpha-amino acid N-acylpyrrolidine Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Primary carboxylic acid amide Proline or derivatives Pyrrolidine Pyrrolidine carboxylic acid Pyrrolidine carboxylic acid or derivatives Secondary alcohol Tertiary carboxylic acid amide Aliphatic heteromonocyclic compounds logp -3.37 ALOGPS logs -0.90 ALOGPS logp -5.4 ChemAxon pka_strongest_acidic 3.45 ChemAxon pka_strongest_basic 8.22 ChemAxon iupac (2S,4R)-1-[(2S)-2-amino-4-carbamoylbutanoyl]-4-hydroxypyrrolidine-2-carboxylic acid ChemAxon average_mass 259.262 ChemAxon mono_mass 259.116820659 ChemAxon smiles N[C@@H](CCC(N)=O)C(=O)N1C[C@H](O)C[C@H]1C(O)=O ChemAxon formula C10H17N3O5 ChemAxon inchi InChI=1S/C10H17N3O5/c11-6(1-2-8(12)15)9(16)13-4-5(14)3-7(13)10(17)18/h5-7,14H,1-4,11H2,(H2,12,15)(H,17,18)/t5-,6+,7+/m1/s1 ChemAxon inchikey HNXKAWFNQGNMNH-VQVTYTSYSA-N ChemAxon polar_surface_area 146.95 ChemAxon refractivity 59.41 ChemAxon polarizability 24.97 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 1 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 162283 Specdb::MsMs 3223411 Specdb::MsMs 3223412 Specdb::MsMs 3223413 Specdb::MsMs 3223414 Specdb::MsMs 3223415 Specdb::MsMs 3223416 Specdb::NmrOneD 13722 Specdb::NmrOneD 13723 Specdb::NmrOneD 13724 Specdb::NmrOneD 13725 Specdb::NmrOneD 13726 Specdb::NmrOneD 13727 Specdb::NmrOneD 13728 Specdb::NmrOneD 13729 Specdb::NmrOneD 13730 Specdb::NmrOneD 13731 Specdb::NmrOneD 13732 Specdb::NmrOneD 13733 Specdb::NmrOneD 13734 Specdb::NmrOneD 13735 Specdb::NmrOneD 13736 Specdb::NmrOneD 13737 Specdb::NmrOneD 13738 Specdb::NmrOneD 13739 Specdb::NmrOneD 13740 Specdb::NmrOneD 13741 FDB111847 156908026