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  <common-name>Cirazoline</common-name>
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  <cas>59939-16-1</cas>
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  <chemical-formula>C13H16N2O</chemical-formula>
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  <specific-gravity nil="true"/>
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  <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">2016-05-22T05:01:57Z</created-at>
  <updated-at type="dateTime">2026-08-19T00:25:27Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
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  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id>DB09202</drugbank-id>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
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  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>[H]N1CCN=C1COC1=CC=CC=C1C1CC1</moldb-smiles>
  <moldb-formula>C13H16N2O</moldb-formula>
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  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.67</logp>
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  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
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  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM018151</chemdb-id>
  <dsstox-id>DTXSID4045131</dsstox-id>
  <toxcast-id>45131</toxcast-id>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00068068</susdat-id>
  <iupac>2-[(2-cyclopropylphenoxy)methyl]-4,5-dihydro-1H-imidazole</iupac>
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  <moldb-polarizability>24.206769025114745</moldb-polarizability>
  <moldb-rotatable-bond-count>4</moldb-rotatable-bond-count>
  <moldb-acceptor-count>3</moldb-acceptor-count>
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  <moldb-pka-strongest-basic>9.258458048758246</moldb-pka-strongest-basic>
  <moldb-physiological-charge>1</moldb-physiological-charge>
  <moldb-number-of-rings>3</moldb-number-of-rings>
  <moldb-alogps-logp>2.62</moldb-alogps-logp>
  <moldb-alogps-logs>-2.74</moldb-alogps-logs>
  <moldb-alogps-solubility>3.89e-01 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Phenol ethers</klass>
  <subklass nil="true"/>
  <paper-count type="integer">424</paper-count>
  <sync-id>CED0011790</sync-id>
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  <structure-pickle>ï¾­Þ������������������������€���8��������`�������`�������(�������(�������`�������(������@(������@h�������@h�������@h�������@h�������@(�������`�������`�������`�����������������(��������� ��h��	h�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:07:32Z</structure-indexed-at>
</compound>
