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<compound>
  <id type="integer">21731</id>
  <title nil="true"/>
  <common-name>Dapoxetine</common-name>
  <description>Dapoxetine is an organic compound with the chemical formula C21H23NO and an average molecular weight of 305.41 g/mol. Dapoxetine belongs to the naphthalenes, a class of benzenoids within the organic compounds.

This compound is associated with three recorded protein targets. These targets include the 5-hydroxytryptamine receptor 1A (HTR1A), the 5-hydroxytryptamine receptor 1B (HTR1B), and the 5-hydroxytryptamine receptor 2C (HTR2C).</description>
  <cas>119356-77-3</cas>
  <pubchem-id>71353</pubchem-id>
  <chemical-formula>C21H23NO</chemical-formula>
  <weight>305.4</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">2016-05-22T07:16:47Z</created-at>
  <updated-at type="dateTime">2026-08-21T18:56:08Z</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>DB04884</drugbank-id>
  <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)[C@@H](CCOC1=CC=CC2=CC=CC=C12)C1=CC=CC=C1</moldb-smiles>
  <moldb-formula>C21H23NO</moldb-formula>
  <moldb-inchi>InChI=1S/C21H23NO/c1-22(2)20(18-10-4-3-5-11-18)15-16-23-21-14-8-12-17-9-6-7-13-19(17)21/h3-14,20H,15-16H2,1-2H3/t20-/m0/s1</moldb-inchi>
  <moldb-inchikey>USRHYDPUVLEVMC-FQEVSTJZSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">305.4134</moldb-average-mass>
  <moldb-mono-mass type="decimal">305.177964363</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.67</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>64453</chemspider-id>
  <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>CHEM020626</chemdb-id>
  <dsstox-id>DTXSID0057627</dsstox-id>
  <toxcast-id>57627</toxcast-id>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00010178</susdat-id>
  <iupac>dimethyl[(1S)-3-(naphthalen-1-yloxy)-1-phenylpropyl]amine</iupac>
  <moldb-polar-surface-area>12.47</moldb-polar-surface-area>
  <moldb-refractivity>96.13870000000004</moldb-refractivity>
  <moldb-polarizability>34.99702376155571</moldb-polarizability>
  <moldb-rotatable-bond-count>6</moldb-rotatable-bond-count>
  <moldb-acceptor-count>2</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>9.043594109021287</moldb-pka-strongest-basic>
  <moldb-physiological-charge>1</moldb-physiological-charge>
  <moldb-number-of-rings>3</moldb-number-of-rings>
  <moldb-alogps-logp>4.75</moldb-alogps-logp>
  <moldb-alogps-logs>-5.56</moldb-alogps-logs>
  <moldb-alogps-solubility>8.37e-04 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Naphthalenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer">724</paper-count>
  <sync-id>CED0009703</sync-id>
  <structure-inchikey>USRHYDPUVLEVMC-FQEVSTJZSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:08:37Z</structure-indexed-at>
</compound>
