Hewitt, M.; Madden, J.C.; Rowe, P.H.; Cronin, M.T.D. Structure-based modelling in reproductive toxicology: (Q)SARs for the placental barrier. SAR QSAR Environ. Res. 2007, 18, 57-76.
Compound
| ID: | 28 | |
|---|---|---|
| Name: | Creatinine | |
| Description: | ||
| Labels: | ||
| CAS: | 60-27-5 | |
| InChi Code: | InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8) |
Properties
CI: Clearance Index
| Value | Source or prediction |
|---|---|
| 0.309 |
experimental value |
| 0.43077 |
Eq.3: QSAR model to predict placental transfer (Training set) |