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<compound>
  <id type="integer">350561</id>
  <title nil="true"/>
  <common-name>[3,5-bis(trifluoromethyl)phenyl]-[(2r)-2-(1h-indol-3-ylmethyl)-4-[[5-(morpholin-4-ylmethyl)-2h-triazol-4-yl]methyl]piperazin-1-yl]methanone</common-name>
  <description>[3,5-bis(trifluoromethyl)phenyl]-[(2r)-2-(1h-indol-3-ylmethyl)-4-[[5-(morpholin-4-ylmethyl)-2h-triazol-4-yl]methyl]piperazin-1-yl]methanone is a chemical compound with the formula C30H31F6N7O2. With an average molecular weight of 635.60 g/mol, [3,5-bis(trifluoromethyl)phenyl]-[(2r)-2-(1h-indol-3-ylmethyl)-4-[[5-(morpholin-4-ylmethyl)-2h-triazol-4-yl]methyl]piperazin-1-yl]methanone is a heavy molecule.</description>
  <cas>393101-98-9</cas>
  <pubchem-id>11635932</pubchem-id>
  <chemical-formula>C30H31F6N7O2</chemical-formula>
  <weight>635.6</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">2026-08-31T15:42:21Z</created-at>
  <updated-at type="dateTime">2026-08-31T15:42:21Z</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>C1CN(C(CN1CC2=NNN=C2CN3CCOCC3)CC4=CNC5=CC=CC=C54)C(=O)C6=CC(=CC(=C6)C(F)(F)F)C(F)(F)F</moldb-smiles>
  <moldb-formula>C30H31F6N7O2</moldb-formula>
  <moldb-inchi>InChI=1S/C30H31F6N7O2/c31-29(32,33)21-11-19(12-22(14-21)30(34,35)36)28(44)43-6-5-42(16-23(43)13-20-15-37-25-4-2-1-3-24(20)25)18-27-26(38-40-39-27)17-41-7-9-45-10-8-41/h1-4,11-12,14-15,23,37H,5-10,13,16-18H2,(H,38,39,40)/t23-/m1/s1</moldb-inchi>
  <moldb-inchikey>SXASYKWUZQHLET-HSZRJFAPSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">635.2443422</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.8</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>CHEM346454</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>[3,5-bis(trifluoromethyl)phenyl]-[(2r)-2-(1h-indol-3-ylmethyl)-4-[[5-(morpholin-4-ylmethyl)-2h-triazol-4-yl]methyl]piperazin-1-yl]methanone</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>Trifluoromethylbenzenes</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0300866</sync-id>
  <structure-inchikey>SXASYKWUZQHLET-UHFFFAOYSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T05:48:33Z</structure-indexed-at>
</compound>
