10967/260 - QDB Compounds

QsarDB Repository

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:34
Name:Dideoxyinosine
Description:
Labels:
CAS:69655-05-6
InChi Code:InChI=1S/C10H12N4O3/c15-3-6-1-2-7(17-6)14-5-13-8-9(14)11-4-12-10(8)16/h4-7,15H,1-3H2,(H,11,12,16)/t6-,7+/m0/s1

Properties

CI: Clearance Index

ValueSource or prediction
0.14

experimental value

0.33951

Eq.3: QSAR model to predict placental transfer (Training set)