<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">281165</id>
  <title nil="true"/>
  <common-name>2-[[2-(dimethylaminodiazenyl)benzoyl]amino]acetic acid</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>24838516</pubchem-id>
  <chemical-formula>C11H14N4O3</chemical-formula>
  <weight>250.25</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">2026-08-26T21:07:22Z</created-at>
  <updated-at type="dateTime">2026-08-26T21:07:22Z</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>CN(C)N=NC1=CC=CC=C1C(=O)NCC(=O)O</moldb-smiles>
  <moldb-formula>C11H14N4O3</moldb-formula>
  <moldb-inchi>InChI=1S/C11H14N4O3/c1-15(2)14-13-9-6-4-3-5-8(9)11(18)12-7-10(16)17/h3-6H,7H2,1-2H3,(H,12,18)(H,16,17)</moldb-inchi>
  <moldb-inchikey>AVCYQJLDSKOQAX-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">250.1065903</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.4</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>CHEM277058</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>2-[[2-(dimethylaminodiazenyl)benzoyl]amino]acetic 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>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Benzoic acids and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0233158</sync-id>
  <structure-inchikey>AVCYQJLDSKOQAX-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2000000000000000800000000000000000000000100004000000000000000000000000000000000010000000000006000000000000000000000002000000000000000000000000000000000000000020000000000000000004000000000000000000010000000000000002004000000000001000000000000000000000000000000040000000800000000000000080100002000100000000000000080000000000000400000000000000680000000000008081000000000000000000000000080000000000000000000000000000000000000000000000400200000000000000000000000000000040000000000400400000000000000100000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������`�������(�������(������@(������@h�������@h�������@h�������@h�������@(�������(�������(�������h��������`�������(�������(�������h��������������� ��(��� ��h���h���h��	h�	
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	�������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:56:17Z</structure-indexed-at>
</compound>
