1.0 2020-03-03 19:29:53 UTC 2020-04-22 15:55:55 UTC BMDB0063914 BMDB63914 Hydroxyprolyl-Gamma-glutamate Hydroxyprolyl-g-glutamate Hydroxyprolyl-g-glutamic acid Hydroxyprolyl-gamma-glutamic acid Hydroxyprolyl-γ-glutamate Hydroxyprolyl-γ-glutamic acid HP-GE dipeptide HPGE dipeptide Hpro-gglu Hydroxyproline gamma-glutamate dipeptide Hydroxyproline-gamma-glutamate dipeptide Hydroxyprolylgamma-glutamate L-Hydroxyprolyl-L-gamma-glutamate 2-Amino-4-[(4-hydroxypyrrolidine-2-carbonyl)-C-hydroxycarbonimidoyl]butanoate C10H17N3O5 259.2591 259.116820669 2-amino-5-[(4-hydroxypyrrolidin-2-yl)formamido]-5-oxopentanoic acid 2-amino-5-[(4-hydroxypyrrolidin-2-yl)formamido]-5-oxopentanoic acid NC(CCC(=O)NC(=O)C1CC(O)CN1)C(O)=O InChI=1S/C10H17N3O5/c11-6(10(17)18)1-2-8(15)13-9(16)7-3-5(14)4-12-7/h5-7,12,14H,1-4,11H2,(H,17,18)(H,13,15,16) NPKNLZYTSOWNFP-UHFFFAOYSA-N belongs to the class of organic compounds known as glutamine and derivatives. Glutamine and derivatives are compounds containing glutamine or a derivative thereof resulting from reaction of glutamine 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 Glutamine and derivatives 1,2-aminoalcohols Alpha amino acid amides Alpha amino acids Amino acids Azacyclic compounds Carbonyl compounds Carboxylic acids Dialkylamines Dicarboximides Heterocyclic fatty acids Hydrocarbon derivatives Hydroxy fatty acids Monoalkylamines Monocarboxylic acids and derivatives N-acyl amines N-unsubstituted carboxylic acid imides Organic oxides Organopnictogen compounds Proline and derivatives Pyrrolidinecarboxamides Secondary alcohols 1,2-aminoalcohol Alcohol Aliphatic heteromonocyclic compound Alpha-amino acid Alpha-amino acid amide Amine Amino acid Azacycle Carbonyl group Carboxylic acid Carboxylic acid imide Carboxylic acid imide, n-unsubstituted Dicarboximide Fatty acid Fatty acyl Glutamine or derivatives Heterocyclic fatty acid Hydrocarbon derivative Hydroxy fatty acid Monocarboxylic acid or derivatives N-acyl-amine Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Proline or derivatives Pyrrolidine Pyrrolidine carboxylic acid or derivatives Pyrrolidine-2-carboxamide Secondary alcohol Secondary aliphatic amine Secondary amine Aliphatic heteromonocyclic compounds logp -3.05 ALOGPS logs -1.40 ALOGPS logp -5.4 ChemAxon pka_strongest_acidic 1.85 ChemAxon pka_strongest_basic 9.59 ChemAxon iupac 2-amino-5-[(4-hydroxypyrrolidin-2-yl)formamido]-5-oxopentanoic acid ChemAxon average_mass 259.2591 ChemAxon mono_mass 259.116820669 ChemAxon smiles NC(CCC(=O)NC(=O)C1CC(O)CN1)C(O)=O ChemAxon formula C10H17N3O5 ChemAxon inchi InChI=1S/C10H17N3O5/c11-6(10(17)18)1-2-8(15)13-9(16)7-3-5(14)4-12-7/h5-7,12,14H,1-4,11H2,(H,17,18)(H,13,15,16) ChemAxon inchikey NPKNLZYTSOWNFP-UHFFFAOYSA-N ChemAxon polar_surface_area 141.75 ChemAxon refractivity 59.41 ChemAxon polarizability 25.13 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 7 ChemAxon donor_count 5 ChemAxon physiological_charge 1 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 25486 Specdb::CMs 40931 Specdb::CMs 173332 Specdb::MsMs 322474 Specdb::MsMs 322475 Specdb::MsMs 322476 Specdb::MsMs 370384 Specdb::MsMs 370385 Specdb::MsMs 370386 Specdb::MsMs 2286613 Specdb::MsMs 2286614 Specdb::MsMs 2286615 Specdb::MsMs 3082284 Specdb::MsMs 3082285 Specdb::MsMs 3082286 Specdb::NmrOneD 13962 Specdb::NmrOneD 13963 Specdb::NmrOneD 13964 Specdb::NmrOneD 13965 Specdb::NmrOneD 13966 Specdb::NmrOneD 13967 Specdb::NmrOneD 13968 Specdb::NmrOneD 13969 Specdb::NmrOneD 13970 Specdb::NmrOneD 13971 Specdb::NmrOneD 13972 Specdb::NmrOneD 13973 Specdb::NmrOneD 13974 Specdb::NmrOneD 13975 Specdb::NmrOneD 13976 Specdb::NmrOneD 13977 Specdb::NmrOneD 13978 Specdb::NmrOneD 13979 Specdb::NmrOneD 13980 Specdb::NmrOneD 13981 FDB111906 35032812 131750768 173850