Anti-ulcer agents

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

For other toxicity and effect values, such as mammalian (rat/mouse) intravenous LD50, fish (fathead minnow) 96-hr LC50, estrogen receptor binding affinity (RBA), use TerraQSAR-RMIV, TerraQSAR-FHM, and TerraQSAR-E2-RBA programs, or consult TerraBase Inc.

NAME CAS FORMULA MWTerraQSAR - LOGP
irsogladine 57381-26-7 C9H7Cl2N5 256.10
1.36
polaprezinc 107667-60-7 C9H12N4O3Zn 289.59
-0.01
metiamide 34839-70-8 C9H16N4S2 244.38
1.44
isotiquimide 56717-18-1 C11H14N2S 206.31
0.76
nitecapone 116313-94-1 C12H11NO6 265.22
2.15
sucrosofate 57680-56-5 C12H14K8O35S8 1287.50
0.00
deboxamet 34024-41-4 C12H14N2O3 234.25
2.21
baxitozine 84386-11-8 C13H14O6 266.25
2.63
zolimidine 1222-57-7 C14H12N2O2S 272.33
1.21
ebrotidine 100981-43-9 C14H17BrN6O2S3 477.43
-0.37
tritoqualine 35619-65-9 C14H19NO4S 297.37
1.90
nolinium bromide 40759-33-9 C15H11BrCl2N2 370.08
2.40
egualen 99287-30-6 C15H18O3S 278.37
3.54
troxipide 30751-05-4 C15H22N2O4 294.35
0.82
propentofylline 55242-55-2 C15H22N4O3 306.37
-0.12
tenatoprazole 113712-98-4 C16H18N4O3S 346.41
2.23
ramixotidine 84071-15-8 C16H21N3O3S 335.43
1.85
acexamic acid 57-08-9 C16H26CaN2O6 382.47
2.23
esomeprazole; see also CAS 161796-78-7 119141-88-7 C17H19N3O3S 345.42
2.23
cetraxate 34675-84-8 C17H23NO4 305.37
2.29
benzotript 39544-74-6 C18H15ClN2O3 342.78
4.27
clanobutin 30544-61-7 C18H18ClNO4 347.80
2.90
nepaprazole [both enantiomers] 156601-79-5 C18H19N3O2S 341.43
2.23
dalcotidine 120958-90-9 C18H29N3O2 319.45
2.03
ilaprazole 172152-36-2 C19H18N4O2S 366.44
2.22
pumaprazole 158364-59-1 C19H22N4O2 338.41
1.78
leminoprazole 104340-86-5 C19H23N3OS 341.48
2.40
ecabapide 104775-36-2 C20H25N3O4 371.44
3.05
ecabet 33159-27-2 C20H28O5S 380.50
1.00
spiriprostil 122946-42-3 C20H34N2O4 366.50
4.32
siltenzepine 98374-54-0 C21H24ClN3O2 385.89
2.80
spiroglumide 137795-35-8 C21H26Cl2N2O4 441.35
1.35
arbaprostil 55028-70-1 C21H34O5 366.50
7.10
rioprostil 77287-05-9 C21H38O4 354.53
7.09
lafutidine 118288-08-7 C22H29N3O4S 431.55
2.55
enisoprost 81026-63-3 C22H36O5 380.52
7.17
benexate 78718-52-2 C23H27N3O4 409.49
3.38
tiopropamine 39516-21-7 C24H27NS 361.55
3.41
budesonide 51333-22-3 C25H34O6 430.54
1.53
setipafant 132418-35-0 C26H23ClN6O2S 519.03
2.18
bisobrin 22407-74-5 C26H36N2O4 440.58
3.06
gefarnate 51-77-4 C27H44O2 400.65
6.24


These data provided free by TerraBase Inc.

Copyright © 2004 by TerraBase Inc.