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: | 61 | |
|---|---|---|
| Name: | Ritodrine | |
| Description: | ||
| Labels: | ||
| CAS: | 26652-09-5 | |
| InChi Code: | InChI=1/C17H21NO3/c1-12(17(21)14-4-8-16(20)9-5-14)18-11-10-13-2-6-15(19)7-3-13/h2-9,12,17-21H,10-11H2,1H3/t12-,17-/s2 |
Properties
CI: Clearance Index
| Value | Source or prediction |
|---|---|
| 0.1 |
experimental value |
| 0.39011 |
Eq.3: QSAR model to predict placental transfer (Training set) |