Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for rat chronic LOAEL. Q13-414-0035. Molcode Ltd., 2010.
Compound
| ID: | 81 | |
|---|---|---|
| Name: | Harmony | |
| Description: | ||
| Labels: | ||
| CAS: | 79277-27-3 | |
| InChi Code: | InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19) |
Properties
LOAEL: Rat chronic LOAEL [log(umol/kg)]
| Value | Source or prediction |
|---|---|
| 1.81 |
experimental value |
| 2.09 |
QSAR: Model for chronic toxicity (Test set) |