Molecular mass (g/mol) | 267.2 | Simcyp library |
LogP | 0.05 | Simcyp library |
Acid dissociation constant (pKa) | 9.7 | Simcyp library |
Blood-to-plasma ratio | 0.91 | Simcyp library |
Unbound fraction (Fu) | 0.8 | Simcyp library |
Fraction absorbed (Fa) | 0.83 | Predicted by advanced dissolution, absorption, and metabolism model |
ka (h−1) | 4.05 | Zhang and Unadkat (2017a) |
Distribution model | Minimal PBPK model |
Steady-state volume of distribution (Vss, liters/kg) | 1.1 | Zhang and Unadkat (2017a) |
Renal clearance (liters/h) | 13.2 | Singlas et al. (1989), Taburet et al. (1990) |
CLint,UGT2B7 (µl/min per milligram) | 29.5 | 6.5 (78% decrease) | Estimated from literature (Singlas et al., 1989; Taburet et al., 1990) and based on protein abundance data |
Additional clearance CLint, P450s, others (liters/h) | 3.07 | 1.01 (67% decrease) | Estimated from literature (Stagg et al., 1992) and based on protein abundance data |