Anticonvulsant 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
paramethadione 115-67-3 C7H11NO3 157.17
3.07
milacemide 76990-56-2 C7H16N2O 144.22
0.43
etiracetam; see also CAS 102767-28-2 33996-58-6 C8H14N2O2 170.21
-1.52
valpromide 2430-27-5 C8H17NO 143.23
2.54
pregabalin 148553-50-8 C8H17NO2 159.23
-1.36
lamotrigine 84057-84-1 C9H7Cl2N5 256.09
1.01
tizanidine 51322-75-9 C9H8ClN5S 253.71
2.70
loreclezole 117857-45-1 C10H6Cl3N3 274.54
3.21
brosuximide 22855-57-8 C10H8BrNO2 254.09
1.84
rufinamide 106308-44-5 C10H8F2N4O 238.20
2.13
buramate 4663-83-6 C10H13NO3 195.22
1.83
sultiame 61-56-3 C10H14N2O4S2 290.36
-0.06
albutoin 830-89-7 C10H16N2OS 212.31
2.15
dezinamide 91077-32-6 C11H11F3N2O2 260.21
2.37
phensuximide 86-34-0 C11H11NO2 189.21
1.33
cinromide 58473-74-8 C11H12BrNO 254.13
2.20
zoniclezole; 5-chloro-3-(1-imidazol-1-ylethyl)-1,2-benzisoxazole 121929-20-2 C12H10ClN3O 247.68
2.45
losigamone 112856-44-7 C12H11ClO4 254.67
2.33
fluzinamide 76263-13-3 C12H13F3N2O2 274.24
2.44
metetoin 5696-06-0 C12H14N2O2 218.26
1.05
tiletamine 14176-49-9 C12H17NOS 223.34
2.33
ralitoline 93738-40-0 C13H13ClN2O2S 296.78
3.21
soretolide 130403-08-6 C13H14N2O2 230.27
1.32
taltrimide 81428-04-8 C13H16N2O4S 296.34
1.21
indeloxazine 60929-23-9 C14H17NO2 231.29
2.97
eslicarbazepine 104746-04-5 C15H14N2O2 254.29
3.47
endixaprine 93181-85-2 C15H15Cl2N3O 324.21
1.29
lodaxaprine 93181-81-8 C15H16ClN3O 289.77
1.33
ameltolide 787-93-9 C15H16N2O 240.31
1.86
ilepcimide 82857-82-7 C15H17NO3 259.30
2.40
suclofenide 30279-49-3 C16H13ClN2O4S 364.81
2.02
citenamide 10423-37-7 C16H13NO 235.29
4.09
fosphenytoin 93390-81-9 C16H15N2O6P 362.28
2.66
retigabine 150812-12-7 C16H18FN3O2 303.34
2.83
morsuximide 3780-72-1 C16H20N2O3 288.35
2.06
fletazepam 34482-99-0 C17H13ClF4N2 356.75
3.63
bentazepam 29462-18-8 C17H16N2OS 296.39
2.73
etifoxine 21715-46-8 C17H17ClN2O 300.79
2.88
etazepine 88124-27-0 C17H17NO2 267.33
2.40
divaplon 90808-12-1 C17H17N3O2 295.34
1.66
diphoxazide 511-41-1 C17H18N2O3 298.34
3.26
mesocarb 34262-84-5 C18H18N4O2 322.37
4.10
flutoprazepam 25967-29-7 C19H16ClFN2O 342.80
3.73
benzobarbital 744-80-9 C19H16N2O4 336.35
1.47
denzimol 73931-96-1 C19H20N2O 292.38
1.71
tonabersat 175013-84-0 C20H19ClFNO4 391.83
3.25
carabersat 184653-84-7 C20H20FNO4 357.38
3.23
dulozafone 75616-02-3 C20H22Cl2N2O4 425.31
3.24
ifenprodil 23210-56-2 C21H27NO2 325.45
4.43
barbexaclone 4388-82-3 C22H33N3O3 387.52
2.86
ganaxolone 38398-32-2 C22H36O2 332.53
4.14
abecarnil 111841-85-1 C24H24N2O4 404.47
3.10
ropizine 3601-19-2 C24H26N4 370.50
3.62
mebeverine 3625-06-7 C25H35NO5 429.56
3.64
nabazenil 58019-65-1 C35H55NO3 537.83
6.24


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