Anxiolytics [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,
or consult TerraBase Inc.


NAME CAS FORMULA MWTerraQSAR-
LOGP
talaglumetad 441765-98-6 C11H16N2O5 256.26
0.96
imepitoin 188116-07-6 C13H14ClN3O2 279.73
2.28
taniplon 106073-01-2 C14H15N5O2 285.31
0.37
ocinaplon 96604-21-6 C17H11N5O 301.31
2.18
oxazolam 24143-17-7 C18H17ClN2O2 328.80
3.22
honokiol 35354-74-6 C18H18O2 266.34
3.00
azacyclonol 115-46-8 C18H21NO 267.37
3.52
pancopride 121650-80-4 C18H24ClN3O2 349.86
2.06
saripidem 103844-86-6 C19H20ClN3O 341.84
3.24
aceprometazine 13461-01-3 C19H22N2OS 326.46
4.68
binospirone 102908-59-8 C20H26N2O4 358.44
2.48
quetiapine 111974-69-7 C21H25N3O2S 383.51
4.31
lorpiprazole 108785-69-9 C21H26F3N5 405.47
2.47
tandospirone 87760-53-0 C21H29N5O2 383.50
1.59
buspirone 36505-84-7 C21H31N5O2 385.51
1.58
serazapine 115313-22-9 C22H23N3O2 361.44
3.99
dextofisopan 82059-50-5 C22H26N2O4 382.46
3.45
levotofisopam 82059-51-6 C22H26N2O4 382.46
3.45
pagoclone 133737-32-3 C23H22Cl1N3O2 407.90
1.93
emapunil; AC-5216 226954-04-7 C23H23N5O2 401.47
2.50
mirisetron 135905-89-4 C24H31N3O2 393.53
1.95


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