Table 1 Summary of input compound parameters of meropenem.
Parameter | Initial value | Source/method | Final modified value |
|---|---|---|---|
Physico-chemical | |||
Lipophilicity | −0.69 ~ −4.4 | Martins 20209 | −1.62 |
pKa-acid | 2.9 | Drugbank | |
MW, g/mol | 383.4 | Drugbank | |
Solubility at PH7, mg/L | 5.63 ~ 7.0 | ALOGPS | |
ADME | |||
fup | 0.98 | Martins 2020 | |
CLrenal(ml/min/kg) | 1.64–3.21 | Rubino 201819 | 3.21 |
Vd(L) | 23.21 | Parameter identification | |
