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: | 23 | |
|---|---|---|
| Name: | Clavulanic acid | |
| Description: | ||
| Labels: | ||
| CAS: | 58001-44-8 | |
| InChi Code: | InChI=1S/C8H9NO5/c10-2-1-4-7(8(12)13)9-5(11)3-6(9)14-4/h1,6-7,10H,2-3H2,(H,12,13)/b4-1-/t6-,7-/m1/s1 |
Properties
CI: Clearance Index
| Value | Source or prediction |
|---|---|
| 0.061 |
experimental value |
| 0.35481 |
Eq.3: QSAR model to predict placental transfer (Training set) |