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: | 31 | |
|---|---|---|
| Name: | Benzoic acid, 2-(acetyloxy)- | |
| Description: | ||
| Labels: | ||
| CAS: | 50-78-2 | |
| InChi Code: | InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12) |
Properties
logK: HPLC chromatographic retention index on immobilized albumin [mM]
| Value | Source or prediction |
|---|---|
| -1.39 |
experimental value |
| -1.1 |
QSAR: Model for in vitro protein binding assay (Training set) |