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<compound>
  <id type="integer">315644</id>
  <title nil="true"/>
  <common-name>6,8-dibromo-3-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylquinazolin-4-one</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>63960</pubchem-id>
  <chemical-formula>C19H14Br2N4O3</chemical-formula>
  <weight>506.1</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">2026-08-29T13:04:28Z</created-at>
  <updated-at type="dateTime">2026-08-29T13:04:28Z</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>CC1=NC2=C(C=C(C=C2Br)Br)C(=O)N1CC3=NN=C(O3)C4=CC=C(C=C4)OC</moldb-smiles>
  <moldb-formula>C19H14Br2N4O3</moldb-formula>
  <moldb-inchi>InChI=1S/C19H14Br2N4O3/c1-10-22-17-14(7-12(20)8-15(17)21)19(26)25(10)9-16-23-24-18(28-16)11-3-5-13(27-2)6-4-11/h3-8H,9H2,1-2H3</moldb-inchi>
  <moldb-inchikey>XCAWMJKUIWTDHR-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">503.94327</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.2</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>CHEM311537</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>6,8-dibromo-3-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylquinazolin-4-one</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>Diazanaphthalenes</klass>
  <subklass>Benzodiazines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0266500</sync-id>
  <structure-inchikey>XCAWMJKUIWTDHR-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000000000000080000000000000020000004000000020200000000000002000000000000400000000000000000080000000008000000000000000000000000020800000000100000280800000000000040000200080014040000000100000800404000100000000000000000000000000010040000000000000000000000000880000000000000000000000000000000000000000000000040000088000000000000000000000000000000001000080010000000000000800000100002000800100008000002820000200040000000000000000000001000040000000000000080000000000000000000000000000</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���h���h��� ��h���h���h���h���h��� ����h���h���h���h�B����������������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:21:50Z</structure-indexed-at>
</compound>
