1.0 2016-05-22 05:46:02 UTC 2026-08-19 14:39:42 UTC Voriconazole SmallMolecule Voriconazole is an organic compound with the formula C16H14F3N5O and an average molecular weight of 349.31 g/mol. Voriconazole belongs to the phenylpropanes, a subclass of benzene and substituted derivatives within the organic compounds. It functions as a biological drug (PMC6263395) and a biological antifungal agent (PMC6979503). At the molecular level, it acts as an antagonist and an inhibitor of Lanosterol 14-alpha demethylase (ERG11). The compound is used in the treatment of candidiasis (PMC7132439) and headache (PMC1492602). Recorded exposure routes for the substance include oral and intravenous administration. Voriconazole is found in or released from nine recorded sources, including antimycotics within healthcare, pharmaceuticals, and veterinary products. Other sources include floors in building and construction; electrical and electronic equipment such as television systems, antennas, magnets, and sparking plugs; and household cleaning and consumer products including non electric simulated smoking devices, cigar cigarettes, and other smoking requisites. Human Neurotoxin C16H14F3N5O 349.3105 349.11504471 (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol voriconazole 137234-62-9 C[C@@H](C1=NC=NC=C1F)[C@](O)(CN1C=NC=N1)C1=C(F)C=C(F)C=C1 InChI=1S/C16H14F3N5O/c1-10(15-14(19)5-20-7-22-15)16(25,6-24-9-21-8-23-24)12-3-2-11(17)4-13(12)18/h2-5,7-10,25H,6H2,1H3/t10-,16+/m0/s1 BCEHBSKCWLPMDN-MGPLVRAMSA-N Organic compounds Benzenoids Benzene and substituted derivatives Phenylpropanes Phenylpropanes Aromatic alcohols Aryl fluorides Azacyclic compounds Fluorobenzenes Halopyrimidines Heteroaromatic compounds Hydrocarbon derivatives Organofluorides Organonitrogen compounds Organopnictogen compounds Tertiary alcohols Triazoles 1,2,4-triazole Alcohol Aromatic alcohol Aromatic heteromonocyclic compound Aryl fluoride Aryl halide Azacycle Azole Fluorobenzene Halobenzene Halopyrimidine Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organofluoride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylpropane Pyrimidine Tertiary alcohol Aromatic heteromonocyclic compounds conazole antifungal drug difluorobenzene pyrimidines tertiary alcohol triazole antifungal drug Detected and Not Quantified Voriconazole Action Pathway SMP0125441 Voriconazole Metabolism SMP0125454 Voriconazole Drug Metabolism Action Pathway SMP0143031 logp 1.82 logp 1.65 ALOGPS logs -3.55 ALOGPS solubility 9.78e-02 g/l ALOGPS logp 1.82 ChemAxon pka_strongest_acidic 12.71 ChemAxon pka_strongest_basic 2.27 ChemAxon iupac (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol ChemAxon average_mass 349.3105 ChemAxon mono_mass 349.11504471 ChemAxon smiles C[C@@H](C1=NC=NC=C1F)[C@](O)(CN1C=NC=N1)C1=C(F)C=C(F)C=C1 ChemAxon formula C16H14F3N5O ChemAxon inchi InChI=1S/C16H14F3N5O/c1-10(15-14(19)5-20-7-22-15)16(25,6-24-9-21-8-23-24)12-3-2-11(17)4-13(12)18/h2-5,7-10,25H,6H2,1H3/t10-,16+/m0/s1 ChemAxon inchikey BCEHBSKCWLPMDN-MGPLVRAMSA-N ChemAxon polar_surface_area 76.72 ChemAxon refractivity 95.28 ChemAxon polarizability 30.54 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 5 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bbfa90d38> DB00582 71616 64684 BE0000233