<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-05 14:06:37 UTC</creation_date>
  <update_date>2026-08-24 03:40:26 UTC</update_date>
  <accession/>
  <common_name>Tavaborole</common_name>
  <class>SmallMolecule</class>
  <description>Tavaborole is an organic compound with the formula C7H6BFO2 and an average molecular weight of 151.93 g/mol. Tavaborole belongs to the aryl fluorides, a subclass of aryl halides within the organic compounds. This compound acts as an inhibitor of leucine--tRNA ligase. It is recorded as being released from healthcare, pharmaceuticals, and veterinary products, specifically as an antifungal for dermatological use. The recorded route of exposure for this substance is topical.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C7H6BFO2</chemical_formula>
  <average_molecular_weight>151.93</average_molecular_weight>
  <monisotopic_moleculate_weight>152.0444881</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>174671-46-6</cas_registry_number>
  <smiles>OB1OCC2=C1C=CC(F)=C2</smiles>
  <inchi>InChI=1S/C7H6BFO2/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3,10H,4H2</inchi>
  <inchikey>LFQDNHWZDQTITF-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>Tavaborole Action Pathway</name>
      <smpdb_id>SMP0125844</smpdb_id>
      <kegg_map_id/>
    </pathway>
    <pathway>
      <name>Tavaborole Drug Metabolism</name>
      <smpdb_id>SMP0130662</smpdb_id>
      <kegg_map_id/>
    </pathway>
    <pathway>
      <name>Tavaborole Drug Metabolism Action Pathway</name>
      <smpdb_id>SMP0144265</smpdb_id>
      <kegg_map_id/>
    </pathway>
  </pathways>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>2.24</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>151.93</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>152.0444881</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>OB1OCC2=C1C=CC(F)=C2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C7H6BFO2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C7H6BFO2/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3,10H,4H2</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>LFQDNHWZDQTITF-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:0x00007f727934e4d0&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id>DB09041</drugbank_id>
  <hmdb_id/>
  <pubchem_compound_id>11499245</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>BE0010215</target_id>
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</compound>
