313563 <common-name>2-[4-(3-methylphenyl)piperazin-1-yl]-1-pyridin-3-ylethanol</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>3044992</pubchem-id> <chemical-formula>C18H23N3O</chemical-formula> <weight>297.4</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">2026-08-29T10:24:33Z</created-at> <updated-at type="dateTime">2026-08-29T10:24:33Z</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>CC1=CC(=CC=C1)N2CCN(CC2)CC(C3=CN=CC=C3)O</moldb-smiles> <moldb-formula>C18H23N3O</moldb-formula> <moldb-inchi>InChI=1S/C18H23N3O/c1-15-4-2-6-17(12-15)21-10-8-20(9-11-21)14-18(22)16-5-3-7-19-13-16/h2-7,12-13,18,22H,8-11,14H2,1H3</moldb-inchi> <moldb-inchikey>ZMIBNAQKEYVEME-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">297.1841124</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>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>CHEM309456</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-[4-(3-methylphenyl)piperazin-1-yl]-1-pyridin-3-ylethanol</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>Diazinanes</klass> <subklass>Piperazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0264468</sync-id> <structure-inchikey>ZMIBNAQKEYVEME-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000020800000000000000000000000002000000000100000000000000000000000000000000000002000000108000004000000000000008000000000000000000000000000000000000000000000010000000000000000000000000000010010000000000001100000000000020100000000000000000004000001104140000000800000000000000200000000000000000000000000000000000000000000000000002400080000000000000000000000008040000800000100000000000420001000000000000000000000000000002000000200000000010000000140000000002040000000000020000000000000000000000000000000</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�B������������� ��������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:20:14Z</structure-indexed-at> </compound>