<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">312158</id>
  <title nil="true"/>
  <common-name>3,9-dimethyl-1-pyridin-4-yl-1,2,3,4-tetrahydropyrido[3,4-b]indole</common-name>
  <description>3,9-dimethyl-1-pyridin-4-yl-1,2,3,4-tetrahydropyrido[3,4-b]indole is a chemical compound with the formula C18H19N3. It has an average molecular weight of 277.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>218501</pubchem-id>
  <chemical-formula>C18H19N3</chemical-formula>
  <weight>277.4</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">2026-08-29T08:29:21Z</created-at>
  <updated-at type="dateTime">2026-08-29T08:29:21Z</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>CC1CC2=C(C(N1)C3=CC=NC=C3)N(C4=CC=CC=C24)C</moldb-smiles>
  <moldb-formula>C18H19N3</moldb-formula>
  <moldb-inchi>InChI=1S/C18H19N3/c1-12-11-15-14-5-3-4-6-16(14)21(2)18(15)17(20-12)13-7-9-19-10-8-13/h3-10,12,17,20H,11H2,1-2H3</moldb-inchi>
  <moldb-inchikey>QFGILLIYWKUDPY-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">277.1578976</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.5</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>CHEM308051</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>3,9-dimethyl-1-pyridin-4-yl-1,2,3,4-tetrahydropyrido[3,4-b]indole</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>Alkaloids and derivatives</superklass>
  <klass>Harmala alkaloids</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0263098</sync-id>
  <structure-inchikey>QFGILLIYWKUDPY-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>100004000000000000000000000000000000000000000000020100000000000000008000000000000000c0002100000000000000000000000000000000000000008000080000000000020008000400000000800000000000000000000000000000000000000040000000400000000000020100000000000000000000100000000040000000800000200000004000000800000100800000000000000001040000040000000000040000080000000000000000000000000000000000000000000000040000001000000000000000000000000000000200000200000000000000000000080000002040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAVAAAAGAAAAIABBgBgAAAAAQMGAGAAAAAD
AQYAYAAAAAICBkAoAAAAAwQGQCgAAAADBAYAYAAAAAMBBwBgAAAAAgEGQCgA
AAADBAZAaAAAAAMDAQZAaAAAAAMDAQdAKAAAAAMDBkBoAAAAAwMBBkBoAAAA
AwMBB0AoAAAAAwMGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMD
AQZAaAAAAAMDAQZAKAAAAAMEBgBgAAAAAQMLAAEAAQIAAgMAAwRoDAQFAAUG
AAUHAAcIaAwICWgMCQpoDAoLaAwLDGgMBA1oDA0OaAwOD2gMDxBoDBARaAwR
EmgMEhNoDA0UAAYBABMDaAwMB2gMEw5oDEIEAAAABgEGBQQDAgYICQoLDAcF
DQQDEw4GDxAREhMOFwQAAAAAAAAAFg==
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:19:10Z</structure-indexed-at>
</compound>
