<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-14 20:02:10 UTC</creation_date>
  <update_date>2026-08-20 02:38:53 UTC</update_date>
  <accession/>
  <common_name>Voxelotor</common_name>
  <class>SmallMolecule</class>
  <description>Voxelotor is an organic compound with the formula C19H19N3O3 and an average molecular weight of 337.38 g/mol. Voxelotor belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. It is categorized as a hematological agent within healthcare, pharmaceuticals, and veterinary products, with oral administration as the recorded exposure route. Regarding its biological activity, Voxelotor acts as a binder of the protein target Hemoglobin subunit alpha (HBA1).</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C19H19N3O3</chemical_formula>
  <average_molecular_weight>337.379</average_molecular_weight>
  <monisotopic_moleculate_weight>337.142641484</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>1446321-46-5</cas_registry_number>
  <smiles>CC(C)N1N=CC=C1C1=C(COC2=CC=CC(O)=C2C=O)C=CC=N1</smiles>
  <inchi>InChI=1S/C19H19N3O3/c1-13(2)22-16(8-10-21-22)19-14(5-4-9-20-19)12-25-18-7-3-6-17(24)15(18)11-23/h3-11,13,24H,12H2,1-2H3</inchi>
  <inchikey>FWCVZAQENIZVMY-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>
    <pathway>
      <name>Voxelotor Drug Metabolism Action Pathway</name>
      <smpdb_id>SMP0145233</smpdb_id>
      <kegg_map_id/>
    </pathway>
  </pathways>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>3.54</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>337.379</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>337.142641484</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>CC(C)N1N=CC=C1C1=C(COC2=CC=CC(O)=C2C=O)C=CC=N1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C19H19N3O3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C19H19N3O3/c1-13(2)22-16(8-10-21-22)19-14(5-4-9-20-19)12-25-18-7-3-6-17(24)15(18)11-23/h3-11,13,24H,12H2,1-2H3</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>FWCVZAQENIZVMY-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:0x00007f3baecf0648&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id>DB14975</drugbank_id>
  <hmdb_id/>
  <pubchem_compound_id>71602803</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id/>
  <kegg_id/>
  <uniprot_id/>
  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
  <ctd_id/>
  <stitch_id/>
  <actor_id/>
  <pdb_id/>
  <wikipidia/>
  <general_references/>
  <targets>
    <target>
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      <target_id>BE0000130</target_id>
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</compound>
