Input parameters for the prediction of PK parameters and simulation of PK profiles of SB939 in human populations using Simcyp
| Parameter | Value |
|---|---|
| Dose (mg) | 10.0 |
| Dosing regimen | Single dose |
| Mol. Wt. (g/mol) | 358.48 |
| LogP | 2.39 |
| Compound type | Diprotic base |
| pKa 1 | 7.45 |
| pKa 2 | 4.13 |
| B/P ratio | 1.0 |
| fu | 0.082 |
| fu (Gut) | 1.0 |
| Enzyme | CYP1A2 |
| CLint (μl · min−1 · pmol isoform−1) | 0.894 |
| fu,mic | 0.34 |
| Enzyme | CYP3A4 |
| CLint (μl · min−1 · pmol isoform−1) | 0.180 |
| fu mic | 0.34 |