Antiparkinsonian compounds

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
lazabemide 103878-84-8 C8H10ClN3O 199.64
-0.37
benserazide 322-35-0 C10H15N3O5 257.25
1.30
pramipexole 104632-26-0 C10H17N3S 211.33
0.52
diprobutine 61822-36-4 C10H23N 157.30
2.82
etilevodopa 37178-37-3 C11H15NO4 225.24
-0.61
rasagiline 136236-51-6 C12H13N 171.24
2.53
tolcapone 134308-13-7 C14H11NO5 273.24
2.11
fipamezole 150586-58-6 C14H15FN2 230.29
1.99
carmantadine 38081-67-3 C14H21NO2 235.33
5.20
piribedil 3605-01-4 C16H18N4O2 298.35
1.51
brasofensine 171655-91-7 C16H20Cl2N2O 327.25
3.09
tofenacin 15301-93-6 C17H21NO 255.36
3.66
minaprine 25905-77-5 C17H22N4O 298.39
1.35
tesofensine 195875-84-4 C17H23Cl2NO 328.28
4.40
diethazine 60-91-3 C18H22N2S 298.45
4.69
depramine 303-54-8 C19H22N2 278.40
4.61
profenamine 522-00-9 C19H24N2S 312.48
4.77
dopamantine 39907-68-1 C19H25NO3 315.41
2.22
methixene 4969-02-2 C20H23NS 309.47
4.25
istradefylline 155270-99-8 C20H24N4O4 384.44
-0.11
prodipine 31314-38-2 C20H25N 279.43
3.93
pridinol 511-45-5 C20H25NO 295.43
3.69
trihexyphenidyl 144-11-6 C20H31NO 301.47
7.64
hexocyclium methylsulfate 115-63-9 C20H34N2O5S 414.56
1.42
ciladopa 80109-27-9 C21H26N2O4 370.45
1.34
bornaprine 20448-86-6 C21H31NO2 329.48
6.03
tropatepine 27574-24-9 C22H23NS 333.50
2.96
lorajmine 47562-08-3 C22H27ClN2O3 402.92
1.68
cinepazide 23887-46-9 C22H31N3O5 417.51
2.75
dexetimide 21888-98-2 C23H26N2O2 362.47
3.89
propiverine 60569-19-9 C24H31NO2 365.52
3.93


These data provided free by TerraBase Inc.

Copyright © 2004 by TerraBase Inc.