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<compound>
  <id type="integer">319840</id>
  <title nil="true"/>
  <common-name>2-[2-(3,3-dimethyl-4h-isoquinolin-1-yl)ethoxy]-n,n-diethylethanamine</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>3079738</pubchem-id>
  <chemical-formula>C19H30N2O</chemical-formula>
  <weight>302.5</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">2026-08-29T18:33:29Z</created-at>
  <updated-at type="dateTime">2026-08-29T18:33:29Z</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>CCN(CC)CCOCCC1=NC(CC2=CC=CC=C21)(C)C</moldb-smiles>
  <moldb-formula>C19H30N2O</moldb-formula>
  <moldb-inchi>InChI=1S/C19H30N2O/c1-5-21(6-2)12-14-22-13-11-18-17-10-8-7-9-16(17)15-19(3,4)20-18/h7-10H,5-6,11-15H2,1-4H3</moldb-inchi>
  <moldb-inchikey>FEXKHYSCTGXRPD-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">302.2358136</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.8</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
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  <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>CHEM315733</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-(3,3-dimethyl-4h-isoquinolin-1-yl)ethoxy]-n,n-diethylethanamine</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>Dihydroisoquinolines</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0270603</sync-id>
  <structure-inchikey>FEXKHYSCTGXRPD-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000020800000000000000000000000000000000200000000100000000002000000000000008000002000000000000000000000000000000000000000200000000000000000000800000000000000001100000000080000000000000000000000000000000000004000000000020808000000000080000000000000000048000000800000000000000000000000000902000000081000000020000000000000001000000000080000000000000000000000800000000000000000004000000000000000000000020000000020000008000000000200400000000000000000000000000140000000000000000001000000040080000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������`������� ������`�������`�������(�������(������� ������`������@(������@h�������@h�������@h�������@h�������@(�������`�������`�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:25:08Z</structure-indexed-at>
</compound>
