<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">356210</id>
  <title nil="true"/>
  <common-name>N-[2-hydroxy-1-[[4-(4-methylphenyl)piperazin-1-yl]methyl]indol-3-yl]imino-2-[4-(2-phenyl-1,8-naphthyridine-3-carbonyl)phenoxy]acetamide</common-name>
  <description>N-[2-hydroxy-1-[[4-(4-methylphenyl)piperazin-1-yl]methyl]indol-3-yl]imino-2-[4-(2-phenyl-1,8-naphthyridine-3-carbonyl)phenoxy]acetamide has the chemical formula C43H37N7O4. With an average molecular weight of 715.80 g/mol, N-[2-hydroxy-1-[[4-(4-methylphenyl)piperazin-1-yl]methyl]indol-3-yl]imino-2-[4-(2-phenyl-1,8-naphthyridine-3-carbonyl)phenoxy]acetamide is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>3077995</pubchem-id>
  <chemical-formula>C43H37N7O4</chemical-formula>
  <weight>715.8</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">2026-09-01T01:28:21Z</created-at>
  <updated-at type="dateTime">2026-09-01T01:28:21Z</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>CC1=CC=C(C=C1)N2CCN(CC2)CN3C4=CC=CC=C4C(=C3O)N=NC(=O)COC5=CC=C(C=C5)C(=O)C6=C(N=C7C(=C6)C=CC=N7)C8=CC=CC=C8</moldb-smiles>
  <moldb-formula>C43H37N7O4</moldb-formula>
  <moldb-inchi>InChI=1S/C43H37N7O4/c1-29-13-17-33(18-14-29)49-24-22-48(23-25-49)28-50-37-12-6-5-11-35(37)40(43(50)53)47-46-38(51)27-54-34-19-15-31(16-20-34)41(52)36-26-32-10-7-21-44-42(32)45-39(36)30-8-3-2-4-9-30/h2-21,26,53H,22-25,27-28H2,1H3</moldb-inchi>
  <moldb-inchikey>DAQGDIBUYQJLPN-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">715.2907027</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>8.2</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>CHEM352103</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>N-[2-hydroxy-1-[[4-(4-methylphenyl)piperazin-1-yl]methyl]indol-3-yl]imino-2-[4-(2-phenyl-1,8-naphthyridine-3-carbonyl)phenoxy]acetamide</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>Organic oxygen compounds</superklass>
  <klass>Organooxygen compounds</klass>
  <subklass>Carbonyl compounds</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0306460</sync-id>
  <structure-inchikey>DAQGDIBUYQJLPN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400000000401000020800002008000000000008000000000000004005000000000000000000000300000000000002004200100000002008000010000800000004000000000000100000080000000000020000000010100000204008000000000000000210000000002000000101000000000021100000000000000000000000000100040000001800000000000000000800000000100000040010000000000040000000000000000040000084000040000020000080400008000000800000000000020040000012000000000000000401000404000002001000200000100010000000140000021002040010000000480000000000000000180080000000000</structure-fingerprint>
  <structure-pattern-fingerprint>7034c2208d32c670cbc45b6583b8a2801a8014f18117207487bd2056ca34e9cc7c622452139000480540c92842c000001c604ba5c08d7265096e753980a24214e7118c893ed0360400901240137a02000c45c591d7211fb752141d6254225b15ec28452f084cb221604d8580ddf4024d7086817a8129ed4ef1992c6c42711a16166d98194ef8820a08973250ca2c0288393d985245469f8b70230a2064c004a489d3109790b2c2300a844d68117c3d144ec50442a9430a4818b04eb0dce14212a0b110e4d5d91b331dc084a6571542d94c410010037070628d71528c2e60030491384d3418890b2c13480413d957a0aa1a50243090c2040e53099a807a090e06</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������6���=���€���`������@(������@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���h���h��� ����	�	
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������������������ !"#��()*+&amp;'�,-./)*�123450����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:54:02Z</structure-indexed-at>
</compound>
