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. Author manuscript; available in PMC: 2016 Jan 7.
Published in final edited form as: Clin Pharmacokinet. 2014 Nov;53(11):1005–1018. doi: 10.1007/s40262-014-0169-7

Table 3. Input variables / parameters for PBPK model of fluconazole (using Simcyp® ).

Molecular weight (g/mol) 306.3
Log P 0.5
pKa (monoprotic base) 1.76
B/P ratio 1
Fu 0.89
CLR (L/h) 1.1

Log P: octanol-water partition coefficient, B/P ratio: blood to plasma concentration ratio

Fu: unbound fraction, CLR: renal clearance