303616 <common-name>4-(diethylamino)-4-oxo-2-(2-phenylethylamino)butanoic acid</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>34302</pubchem-id> <chemical-formula>C16H24N2O3</chemical-formula> <weight>292.37</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-28T20:57:11Z</created-at> <updated-at type="dateTime">2026-08-28T20:57:11Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CCN(CC)C(=O)CC(C(=O)O)NCCC1=CC=CC=C1</moldb-smiles> <moldb-formula>C16H24N2O3</moldb-formula> <moldb-inchi>InChI=1S/C16H24N2O3/c1-3-18(4-2)15(19)12-14(16(20)21)17-11-10-13-8-6-5-7-9-13/h5-9,14,17H,3-4,10-12H2,1-2H3,(H,20,21)</moldb-inchi> <moldb-inchikey>VUTCJOYAJOMIFY-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">292.1786926</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-0.7</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM299509</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>4-(diethylamino)-4-oxo-2-(2-phenylethylamino)butanoic acid</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0254793</sync-id> <structure-inchikey>VUTCJOYAJOMIFY-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000010000800000000000000000000000000000000000010010000000000002000000000000000000000005000000000000000000000000000010000000000000000000000000000000000020001000000000000000008000000000020000010000000000000000004000000000000800000000002000000080000000040040200000800000000000000080000000080100000000021000000000002000000000000000000000080000000000000000000000000000001000000000000000000000000000008000000000000000000000000000000220000000000000000000000800000040000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>400000200102060088000100010820000000040000052000003000400200000c40020050008000000000410800800000042000a5808c30010200643000a04000c6110400020004004090102000620100000401805000013240000422000009000c200406004002000000100054340000200080500105e0043118020002110002004400180ce0820808020200882c0008111c0012444014820004080000400080004300000010c00000000940057c25104ac002008841084010000210084002100010000404400002018002040441028000000000020040000d000000080100000000081000010000004000004002200000100010804200260000008052400006</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������`�������`�������(�������(�������`�������`�������(�������(�������h��������`�������`�������`������@(������@h�������@h�������@h�������@h�������@h��������������������� ��(�������� � (� � ���� � �������h���h���h���h���h���h�B���������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:12:55Z</structure-indexed-at> </compound>