Fluconazole

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 272
Total Number of Articles : 450
PubChem 3365
Molecular Formula

C13H12F2N6O

SMILES

C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O

InChI

InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2

synonyms
  • fluconazole
  • 86386-73-4
  • Diflucan
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Properties
Property Value
MW 306.27 g/mol
HBD 1
HBA 7
Rotatable Bond Count 5
Exact Mass 306.10406535 g/mol
Monoisotopic Mass 306.10406535 g/mol
Heavy Atom Count 22
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 358
xlogp 0.4
Topological Polar Surface Area 81.6