<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-05 13:38:45 UTC</creation_date>
  <update_date>2026-08-22 00:01:14 UTC</update_date>
  <accession/>
  <common_name>Cyt-387</common_name>
  <class>SmallMolecule</class>
  <description>Cyt-387 is an organic compound with the chemical formula C23H22N6O2 and an average molecular weight of 414.47 g/mol. Cyt-387 belongs to the pyrimidines and pyrimidine derivatives, a subclass of diazines within the organic compounds.

Within the superclass of organoheterocyclic compounds, this substance is identified as an antineoplastic agent used in healthcare, pharmaceuticals, and veterinary products. It has been recorded as being administered via the oral exposure route. Cyt-387 acts on six recorded protein targets, serving as an inhibitor of Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, Tyrosine-protein kinase JAK3, and Non-receptor tyrosine-protein kinase TYK2, as well as two other proteins.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C23H22N6O2</chemical_formula>
  <average_molecular_weight>414.469</average_molecular_weight>
  <monisotopic_moleculate_weight>414.1804239</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>1056634-68-4</cas_registry_number>
  <smiles>O=C(NCC#N)C1=CC=C(C=C1)C1=CC=NC(NC2=CC=C(C=C2)N2CCOCC2)=N1</smiles>
  <inchi>InChI=1S/C23H22N6O2/c24-10-12-25-22(30)18-3-1-17(2-4-18)21-9-11-26-23(28-21)27-19-5-7-20(8-6-19)29-13-15-31-16-14-29/h1-9,11H,12-16H2,(H,25,30)(H,26,27,28)</inchi>
  <inchikey>ZVHNDZWQTBEVRY-UHFFFAOYSA-N</inchikey>
  <taxonomy>
    <kingdom/>
    <super_class/>
    <class/>
    <sub_class/>
    <direct_parent/>
    <alternate_parents/>
    <substituents/>
    <molecular_framework/>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>2.7</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>414.469</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>414.1804239</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>O=C(NCC#N)C1=CC=C(C=C1)C1=CC=NC(NC2=CC=C(C=C2)N2CCOCC2)=N1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C23H22N6O2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C23H22N6O2/c24-10-12-25-22(30)18-3-1-17(2-4-18)21-9-11-26-23(28-21)27-19-5-7-20(8-6-19)29-13-15-31-16-14-29/h1-9,11H,12-16H2,(H,25,30)(H,26,27,28)</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>ZVHNDZWQTBEVRY-UHFFFAOYSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
  <mechanism_of_toxicity/>
  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f721f7a3df0&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id>DB11763</drugbank_id>
  <hmdb_id/>
  <pubchem_compound_id>25062766</pubchem_compound_id>
  <chembl_id/>
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  <kegg_id/>
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  <biocyc_id/>
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  <wikipidia/>
  <general_references/>
  <targets>
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</compound>
