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: | 81 | |
|---|---|---|
| Name: | 1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione | |
| Description: | ||
| Labels: | ||
| CAS: | 58-08-2 | |
| InChi Code: | InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3 |
Properties
logK: HPLC chromatographic retention index on immobilized albumin [mM]
| Value | Source or prediction |
|---|---|
| -0.92 |
experimental value |
| -0.92 |
QSAR: Model for in vitro protein binding assay (Test set) |