1.0 2016-05-22 03:40:27 UTC 2026-08-20 06:30:26 UTC Enalapril SmallMolecule Enalapril is an organic compound with the formula C20H28N2O5 and an average molecular weight of 376.45 g/mol. Enalapril belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It acts as an inhibitor of the protein target Angiotensin-converting enzyme (ACE). The compound is found in or released from three recorded sources: antennas in electrical and electronic equipment, drinking water in drinking water and water supply, and ACE inhibitors in healthcare, pharmaceuticals, and veterinary products. The recorded exposure route for this substance is oral. Human Neurotoxin C20H28N2O5 376.4467 376.199822016 (2S)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]pyrrolidine-2-carboxylic acid enalapril 75847-73-3 CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1 GBXSMTUPTTWBMN-XIRDDKMYSA-N Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Dipeptides Alpha amino acid amides Alpha amino acid esters Amino acids Aralkylamines Azacyclic compounds Benzene and substituted derivatives Carbonyl compounds Carboxylic acid esters Carboxylic acids Dialkylamines Dicarboxylic acids and derivatives Fatty acid esters Hydrocarbon derivatives N-acyl-L-alpha-amino acids N-acylpyrrolidines Organic oxides Organopnictogen compounds Proline and derivatives Pyrrolidine carboxylic acids Tertiary carboxylic acid amides Alpha-amino acid amide Alpha-amino acid ester Alpha-amino acid or derivatives Alpha-dipeptide Amine Amino acid Amino acid or derivatives Aralkylamine Aromatic heteromonocyclic compound Azacycle Benzenoid Carbonyl group Carboxamide group Carboxylic acid Carboxylic acid ester Dicarboxylic acid or derivatives Fatty acid ester Fatty acyl Hydrocarbon derivative Monocyclic benzene moiety 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 Proline or derivatives Pyrrolidine Pyrrolidine carboxylic acid Pyrrolidine carboxylic acid or derivatives Secondary aliphatic amine Secondary amine Tertiary carboxylic acid amide Aromatic heteromonocyclic compounds dicarboxylic acid monoester dipeptide Detected and Not Quantified Enalapril Action Pathway SMP0000148 Enalapril Metabolism Pathway SMP0000593 Enalapril ACE Inhibitor Action Pathway SMP0123086 Enalapril Drug Metabolism Action Pathway SMP0143033 logp 0.59 logp 0.19 ALOGPS logs -3.25 ALOGPS solubility 2.13e-01 g/l ALOGPS logp 0.59 ChemAxon pka_strongest_acidic 3.67 ChemAxon pka_strongest_basic 5.2 ChemAxon iupac (2S)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]pyrrolidine-2-carboxylic acid ChemAxon average_mass 376.4467 ChemAxon mono_mass 376.199822016 ChemAxon smiles CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O ChemAxon formula C20H28N2O5 ChemAxon inchi InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1 ChemAxon inchikey GBXSMTUPTTWBMN-XIRDDKMYSA-N ChemAxon polar_surface_area 95.94 ChemAxon refractivity 99.57 ChemAxon polarizability 40.41 ChemAxon rotatable_bond_count 10 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bafac7be0> DB00584 40466924 4534998 BE0000221