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: | 77 | |
|---|---|---|
| Name: | Zalcitabine | |
| Description: | ||
| Labels: | ||
| CAS: | 7481-89-2 | |
| InChi Code: | InChI=1S/C9H13N3O3/c10-7-3-4-12(9(14)11-7)8-2-1-6(5-13)15-8/h3-4,6,8,13H,1-2,5H2,(H2,10,11,14)/t6-,8+/m0/s1 |
Properties
CI: Clearance Index
| Value | Source or prediction |
|---|---|
| 0.22 |
experimental value |
| 0.34669 |
Eq.3: QSAR model to predict placental transfer (Training set) |