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: | 52 | |
|---|---|---|
| Name: | PCB-52 | |
| Description: | ||
| Labels: | ||
| CAS: | 35693-99-3 | |
| InChi Code: | InChI=1S/C12H6Cl4/c13-7-1-3-11(15)9(5-7)10-6-8(14)2-4-12(10)16/h1-6H |
Properties
CI: Clearance Index
| Value | Source or prediction |
|---|---|
| 0.74 |
experimental value |
| 1.125 |
Eq.3: QSAR model to predict placental transfer (Training set) |