Ran, Y.; He, Y.; Yang, G.; Johnson, J. L. H.; Yalkowsky, S. H. Estimation of aqueous solubility of organic compounds by using the general solubility equation. Chemosphere 2002, 48, 487–509.
Compound
| ID: | 841 | |
|---|---|---|
| Name: | 2-Methoxypteridine | |
| Description: | ||
| Labels: | ||
| CAS: | 102170-44-5 | |
| InChi Code: | InChI=1S/C7H6N4O/c1-12-7-10-4-5-6(11-7)9-3-2-8-5/h2-4H,1H3 |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -1.11 |
experimental value |
| -0.84 |
Eq.1: General solubility equation (Test set to verify GSE) |