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: | 29 | |
|---|---|---|
| Name: | 4-butyl-1,2-diphenylpyrazolidine-3,5-dione | |
| Description: | ||
| Labels: | ||
| CAS: | 50-33-9 | |
| InChi Code: | InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3 |
Properties
logK: HPLC chromatographic retention index on immobilized albumin [mM]
| Value | Source or prediction |
|---|---|
| 0.19 |
experimental value |
| 0.164 |
QSAR: Model for in vitro protein binding assay (Training set) |