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  <common-name>5-[(3-methyl-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-2-[4-[(3-methyl-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-2-sulfophenyl]benzenesulfonic acid</common-name>
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  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
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  <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">2026-08-31T18:06:52Z</created-at>
  <updated-at type="dateTime">2026-08-31T18:06:52Z</updated-at>
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  <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>CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)S(=O)(=O)O)S(=O)(=O)O)C6=CC=CC=C6</moldb-smiles>
  <moldb-formula>C32H26N8O8S2</moldb-formula>
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  <moldb-inchikey>WBBRXOTXXGMTND-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">714.1315022</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.8</logp>
  <hmdb-id nil="true"/>
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  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM347915</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>5-[(3-methyl-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-2-[4-[(3-methyl-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-2-sulfophenyl]benzenesulfonic 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>Biphenyls and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0302312</sync-id>
  <structure-inchikey>WBBRXOTXXGMTND-UHFFFAOYSA-N</structure-inchikey>
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  <structure-pickle>ï¾­Þ����������������2���7���€���`�������(�������(�������(�������(�������(�������`�������(�������(������@(������@h�������@(������@(������@h�������@h�������@(������@(������@h�������@(������@h�������@h��������(�������(�������`�������(�������(�������(�������(�������(������@(������@h�������@h�������@h�������@h�������@h��������`������� ������(�������(�������`������� ������(�������(�������`������@(������@h�������@h�������@h�������@h�������@h������������(��� �� ��(���������(��	 	
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�h���h��h��h��� ��h���h���h���h���h��� ��(���������(��� �� ��(��� ��h���h�� h� !h�!"h��#��$�$%��$&amp;��$'��(�()��(*��(+��, ,-h�-.h�./h�/0h�01h�����	h���h����"�h�1,h�B�����������
���	���������������� !"��-./01,����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:49:51Z</structure-indexed-at>
</compound>
