Leukotriene antagonists [selection]

TerraQSAR-LOGPTM computed octanol/water partition coefficients (CLOGPs).


For other toxicity and effect values, such as mammalian (rat/mouse) intravenous LD50, mammalian (rat/mouse) oral LD50,
Daphnia magna 48-hr LC50, fish (fathead minnow) 96-hr LC50, estrogen receptor binding affinity (RBA), skin irritation potential,
use TerraQSAR-RMIV, TerraQSAR-OMAR, TerraQSAR-Daphnia, TerraQSAR-FHM, TerraQSAR-E2-RBA, or TerraQSAR-SKIN programs,


NAME CAS FORMULA MWTerraQSAR - LOGP
acitazanolast 114607-46-4 C9H7N5O3 233.19
-0.32
tomelukast 88107-10-2 C16H22N4O3 318.38
1.12
ritolukast 111974-60-8 C17H13F3N2O3S 382.36
2.34
fenleuton 141579-54-6 C17H15FN2O3 314.32
3.23
pirodomast 108310-20-9 C18H17N3O2 307.35
3.19
honokiol 35354-74-6 C18H18O2 266.34
3.00
ontazolast 147432-77-7 C21H25N3O 335.45
3.55
ticolubant 154413-61-3 C23H19Cl2NO3S 460.38
2.96
sulukast 98116-53-1 C25H36N4O3S 472.65
4.28
verlukast 120443-16-5 C26H27ClN2O3S2 515.09
6.61
pobilukast 107023-41-6 C26H34O5S 458.62
2.25
moxilubant 146978-48-5 C26H37N3O4 455.60
2.95
ablukast 96566-25-5 C28H34O8 498.57
3.88
tipekulast 125961-82-2 C29H38O7S 530.68
3.10
masikulast 136564-68-6 C31H32F3N3O5S 615.67
2.63
zafirlukast 107753-78-6 C31H33N3O6S 575.68
1.64
amelubant 346735-24-8 C33H34N2O5 538.64
4.93
montelukast 158966-92-8 C35H36ClNO3S 586.19
5.39


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