<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">317248</id>
  <title nil="true"/>
  <common-name>8-[3-(dimethylamino)propoxy]-3-pyridin-4-ylchromen-2-one</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>22203</pubchem-id>
  <chemical-formula>C19H20N2O3</chemical-formula>
  <weight>324.4</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">2026-08-29T15:18:01Z</created-at>
  <updated-at type="dateTime">2026-08-29T15:18:01Z</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>CN(C)CCCOC1=CC=CC2=C1OC(=O)C(=C2)C3=CC=NC=C3</moldb-smiles>
  <moldb-formula>C19H20N2O3</moldb-formula>
  <moldb-inchi>InChI=1S/C19H20N2O3/c1-21(2)11-4-12-23-17-6-3-5-15-13-16(19(22)24-18(15)17)14-7-9-20-10-8-14/h3,5-10,13H,4,11-12H2,1-2H3</moldb-inchi>
  <moldb-inchikey>OQMWRXMKONOZIA-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">324.1473925</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"/>
  <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>CHEM313141</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>8-[3-(dimethylamino)propoxy]-3-pyridin-4-ylchromen-2-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>Phenylpropanoids and polyketides</superklass>
  <klass>Coumarins and derivatives</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0268074</sync-id>
  <structure-inchikey>OQMWRXMKONOZIA-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40400000000000000800000000000040000000000000000000002000000000000000000000020000000008000002100000000000000000000000000000000000000000080000000000000000000000028800000000500000000000000000000000000000000000000000000104000000000000000200000000000040000000001000040000001800000000000000000900000000000800000100000000000000000000000000040200000080000002000000000080008000000000002000000000000000100001900000000000000000000000000000000000200000000004000000000000001002040000000010000000001000020000000000000000000</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�B��������
	������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:23:08Z</structure-indexed-at>
</compound>
