Table 10.

Applications of PBPK in predicting ADMET properties from 2016 to 2018.

Year	Tool	Compound /Preparations	Properties	References
2016	GastroPlus	Alectinib	Oral bioavailability, Aqueous solubility, Cmax, AUC	Parrott et al., 2016
2016	GastroPlus	Bisoprolol, Nifedipine, Cimetidine, Furosemide	Oral absorption	Hansmann et al., 2016
2016	GastroPlus	Carvedilol loaded nanocapsules (CLN)	AUC, Cmax	George et al., 2016
2016	GastroPlus	Ketoconazole, Erythromycin	AUC, Cmax	Boetsch et al., 2016
2016	GastroPlus	Levofloxacin	logP, Plasma protein binding, AUC, Cmax	Zhu et al., 2016
2016	GastroPlus	Met XR 1000 mg tablets	Dose, logD, AUC, Cmax	Chen W. et al., 2016
2016	PKSim	Azathioprine	Hepatotoxicity	Thiel et al., 2016
2016	PKSim	Morphine and Furosemide	Vss value	Schlender et al., 2016
2016	WinNonlin	6-chloro-9-nitro-5-oxo-5H-benzo-(a)-phenoxazine (CNOB)	AUC, Vd, CL, half-life	Wang J. H. et al., 2016
2016	WinNonlin	Arbekacin	Vd	Hagihara et al., 2016
2016	WinNonlin	Busulfan (BU)	AUC, apparent clearance	de Castro et al., 2016
2016	WinNonlin	Cetuximab (CTX), Capecitabine (CCB)	Cmax, AUC, Vd	Rachar et al., 2016
2016	WinNonlin	Glibenclamide	CL, Vd, half-life	Rambiritch et al., 2016
2016	WinNonlin	Imatinib mesylate	Bioavailability, Tmax, Cmax	Arora et al., 2016
2016	WinNonlin	Midazolam	Cmax, Vd	Vuu et al., 2016
2016	WinNonlin	Midazolam, Irinotecan	Clearance rate	Lee et al., 2016
2016	WinNonlin	Perfluorooctanoic acid (PFOA), Perfluorooctanesulfonic acid (PFOS), Perfluorohexane sulfonic acid (PFHxS)	AUC, renal clearance, Cmax, Vd	Kim et al., 2016
2016	WinNonlin	Propofol	Plasma concentrations, Vd	Chen J. Y. et al., 2016
2016	WinNonlin	Sodium succinate, Polysorbate, Arginine, Phosphate-buffered saline (PBS)	CL, Half-life, Cmax	Gupta et al., 2016
2016	WinNonlin	Tacrine hydrochloride	Skin penetration	Patel et al., 2016
2016	WinNonlin	Tilmicosin	AUC, Cmax	Zhang et al., 2016
2016	WinNonlin	Treosulfan (TREO)	Cmax, AUC	Romanski et al., 2016
2017	WinNonlin	Tacrolimus	Plasma clearance	David-Neto et al., 2017
2017	GastroPlus	Basmisanil	logD, Solubility	Yang et al., 2017
2017	GastroPlus	Buagafuran	Plasma Protein Binding, logP	Yang et al., 2017
2017	GastroPlus	Compound A (CPD A)	Bioavailability, Cmax, AUC	Stillhart et al., 2017
2017	GastroPlus	Mangiferin	Aqueous solubility, logD, logP, Permeability	Khurana et al., 2017
2017	PKSim	Cefazolin, Cefuroxime, Cefradine	CL	Dallmann et al., 2017
2017	PKSim	Endogenous IgG	CL, Vd	Niederalt et al., 2017
2017	PKSim	Fentanyl, Alfentanil, Thiopental, Omadacycline, Amiodarone, Propylthiouracil	Plasma concentration	Pilari et al., 2017
2017	PKSim	Vorinostat	Dose	Moj et al., 2017
2017	WinNonlin	Acetylkitasamycin	Cmax, Tmax, AUC	Nan et al., 2017
2017	WinNonlin	Benznidazole	Cmax, AUC	Molina et al., 2017
2017	WinNonlin	Ceftiofur	CL, Vd	Wang J. et al., 2017
2017	WinNonlin	Cloxacillin	Dose	Burmanczuk et al., 2017
2017	WinNonlin	Danofloxacin	AUC	Zhang N. et al., 2017
2017	WinNonlin	Diaveridine	Oral bioavailability, Cmax, AUC	Li Y. F. et al., 2017
2017	WinNonlin	Enrofloxacin	Plasma concentration	Shan et al., 2017
2017	WinNonlin	Iohexol	CL	Zhang C. et al., 2017
2017	WinNonlin	Lurasidone	Cmax, AUC	Hu et al., 2017
2017	WinNonlin	Meropenem	Plasma concentration	Kong et al., 2017
2017	WinNonlin	Metolazone	AUC, Cmax, Tmax	Li X. et al., 2017
2017	WinNonlin	Psilocybin	Nephrotoxicity	Brown et al., 2017
2017	WinNonlin	Pyrazinamide	Cmax	Voelkner et al., 2017
2017	WinNonlin	Sarafloxacin	Dose	Yu et al., 2017
2017	WinNonlin	Sildenafil	CL, Tmax, Vd	Olguin et al., 2017
2017	WinNonlin	Tenofovir	CL, Plasma concentration	Du X. et al., 2017
2017	WinNonlin	Tilmicosin	AUC, Tmax, half-life	Zhang L. et al., 2017
2017	WinNonlin	Treosulfan	Liver, Brain toxicity	Romanski et al., 2017
2017	WinNonlin	Tulathromycin	Dose	Zhou et al., 2017
2018	GastroPlus	Cefadroxil	Permeability, logP, Aqueous solubility, Distribution volume	Hu and Smith, 2018
2018	GastroPlus	Compound-A	Bioavailability, logP, Permeability, Aqueous solubility	Kou et al., 2018
2018	GastroPlus	Dasatinib	AUC, Cmax, Tmax	Vaidhyanathan et al., 2018
2018	GastroPlus	DPP-4 inhibitors	Bioavailability	Daga et al., 2018
2018	GastroPlus	Lanabecestat (AZD3293)	Bioavailability	Ye et al., 2018
2018	GastroPlus	Tramadol	Renal clearance	T'Jollyn et al., 2018
2018	PKSim	Carvedilol	Plasma concentration	Ibarra et al., 2018
2018	PKSim	Escitalopram	Plasma exposure	Delaney et al., 2018
2018	PKSim	Indomethacin, Felodipine	Plasma exposure	Keemink et al., 2018
2018	PKSim	Pregabalin	Plasma concentrations	Idkaidek et al., 2018b
2018	WinNonlin	Cefquinome	Cmax, AUC	Shan et al., 2018
2018	WinNonlin	Dexmedetomidine	CL, Vd	Song et al., 2018
2018	WinNonlin	Gentamicin	AUC	Gestrich et al., 2018
2018	WinNonlin	Gliclazide	Vd, CL	Shaik et al., 2018
2018	WinNonlin	Letrozole	Dose	Arora et al., 2018
2018	WinNonlin	Moxidectin	CL, Tmax, Cmax	Xiao et al., 2018
2018	WinNonlin	Penicillin G	Vd, CL, half-life	Padari et al., 2018
2018	WinNonlin	Seroquel XR, Quesero XR	AUC, Cmax, CL	Huang et al., 2018
2018	WinNonlin	Sitagliptin	Cmax, Tmax, AUC, T1/2	Sangle et al., 2018
2018	WinNonlin	Vitacoxib	Plasma concentrations, Cmax, AUC	Wang et al., 2018a
2018	WinNonlin	Amoxicillin/clavulanic acid tablets	Cmax, Tmax, AUC, T1/2	De Velde et al., 2018
2018	WinNonlin	Phenylbutyric acid (PBA), phenylacetic acid (PAA), and phenylacetylglutamine (PAGN), UPAGN	Plasma concentrations, AUC, Tmax	Berry et al., 2018
2018	WinNonlin	Siponimod	T1/2	Jin et al., 2018
2018	WinNonlin	Lacosamide	T1/2, Vd, Cmax, CL, AUC	Franquiz et al., 2018
2018	WinNonlin	Tildipirosin (TD)	Cmax, AUC, Tmax	Wang et al., 2018b
2018	WinNonlin	Streptomycin	T1/2, AUC, Tmax, Cmax	Chen and Gao, 2018
2018	WinNonlin	Pantoprazole	T1/2, AUC, Vd/F, CL/F	Shakhnovich et al., 2018
2018	WinNonlin	FVIII concentrates	T1/2	Cheng X. et al., 2018
2018	WinNonlin	Adherence to tenofovir disoproxil fumarate/emtricitabine (TDF/FTC)	Cmax, AUC	Ibrahim et al., 2018
2018	WinNonlin	Valsartan, Hydrochlorothiazide (HCT)	Cmax, Tmax, AUC, T1/2, Kel	Idkaidek et al., 2018a
2018	WinNonlin	Individual total serum cortisol, unbound serum cortisol and salivary cortisone	Cmax, AUC, Tmax, Bioavailability	Johnson et al., 2018

LogP, octanol-water partition coefficient; LogD, octanol-water distribution coefficient; AUC, area under the curve; C_max, peak concentration; Vss, steady-state; V_d, volume of distribution; T_1/2, half-life; logP, octanol-water partition coefficient; logD, octanol-water distribution coefficient; CL, clearance; CL/F, body clearance corrected for bioavailability; V_d/F, volume of distribution corrected for bioavailability. K_el, elimination rate constant; F, bioavailability; T_max, time to maximum concentration.