<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">332809</id>
  <title nil="true"/>
  <common-name>1-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]propan-2-ol</common-name>
  <description>1-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]propan-2-ol is a chemical compound with the formula C22H29ClN2O. It has an average molecular weight of 372.90 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>91079</pubchem-id>
  <chemical-formula>C22H29ClN2O</chemical-formula>
  <weight>372.9</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">2026-08-30T14:02:21Z</created-at>
  <updated-at type="dateTime">2026-08-30T14:02:21Z</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>CC(CN1CCN(CC1)CCC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)O</moldb-smiles>
  <moldb-formula>C22H29ClN2O</moldb-formula>
  <moldb-inchi>InChI=1S/C22H29ClN2O/c1-18(26)17-25-15-13-24(14-16-25)12-11-22(19-5-3-2-4-6-19)20-7-9-21(23)10-8-20/h2-10,18,22,26H,11-17H2,1H3</moldb-inchi>
  <moldb-inchikey>LFKOKGROIUWPMC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">372.1968412</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.2</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>CHEM328702</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>1-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]propan-2-ol</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>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Diphenylmethanes</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0283310</sync-id>
  <structure-inchikey>LFKOKGROIUWPMC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>5000000000000000003080000000000000000000000000000000008010000000000000100000000000000800000000000400000000000000000000000000000000000000000040000000000000000000000000000000000000000000100000000000000001008000000000000000002000024002010000000000000000000000000000004002000080000000000000400000000000010000000000000000000000000000000000000000840008000000000000000000000000a040000000000000000000000400000000000000000000000010000000000000000200000000010000000000000004000040000000000020000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`������� ������`�������`������� ������`�������`�������`�������`�������`������@(������@h�������@h�������@h�������@h�������@h�������@(������@h�������@h�������@(������@h�������@h�������� ������`�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:35:01Z</structure-indexed-at>
</compound>
