Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for human serum albumin binding. Q13-59-0008. Molcode Ltd., 2009.
Compound
| ID: | 49 | |
|---|---|---|
| Name: | Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, ethyl ester | |
| Description: | ||
| Labels: | ||
| CAS: | 637-07-0 | |
| InChi Code: | InChI=1S/C12H15ClO3/c1-4-15-11(14)12(2,3)16-10-7-5-9(13)6-8-10/h5-8H,4H2,1-3H3 |
Properties
logK: HPLC chromatographic retention index on immobilized albumin [mM]
| Value | Source or prediction |
|---|---|
| 0.27 |
experimental value |
| -0.0351 |
QSAR: Model for in vitro protein binding assay (Training set) |