<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">335316</id>
  <title nil="true"/>
  <common-name>N-[9-[4-(ethylsulfonylamino)anilino]acridin-3-yl]acetamide</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>40676</pubchem-id>
  <chemical-formula>C23H22N4O3S</chemical-formula>
  <weight>434.5</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">2026-08-30T17:26:24Z</created-at>
  <updated-at type="dateTime">2026-08-30T17:26:24Z</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>CCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)NC(=O)C</moldb-smiles>
  <moldb-formula>C23H22N4O3S</moldb-formula>
  <moldb-inchi>InChI=1S/C23H22N4O3S/c1-3-31(29,30)27-17-10-8-16(9-11-17)25-23-19-6-4-5-7-21(19)26-22-14-18(24-15(2)28)12-13-20(22)23/h4-14,27H,3H2,1-2H3,(H,24,28)(H,25,26)</moldb-inchi>
  <moldb-inchikey>SWPICRJGDWAOAU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">434.1412618</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.6</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>CHEM331209</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>N-[9-[4-(ethylsulfonylamino)anilino]acridin-3-yl]acetamide</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>Organoheterocyclic compounds</superklass>
  <klass>Quinolines and derivatives</klass>
  <subklass>Benzoquinolines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0285790</sync-id>
  <structure-inchikey>SWPICRJGDWAOAU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>8000000000000000000000c0008100000000080004000000000042000000000000020000002404000000000000000000000000100000000020000000000000080000000000000020000000000000000000000000000000000000010000000010400000100000000000000000000000000000000000408000008040000000804020000000000480000000000100000000000000000200000008000000000000040000080000000000000000000000082000000000080000000000040000000000000000000000000004000000000004000200000000000000008000000001000040000000000400000000000000000000000000000000</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�������@h�������@h�������@h�������@(�������h��������(�������(�������`������������������������� ��h���h��	h�	
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	��������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:37:01Z</structure-indexed-at>
</compound>
