| ID | Name | CAS | Data |
logPoct/wat |
| 14-562-2 |
D-Alanine, N-(2,4-difluorobenzoyl)-, propyl ester
|
|
5 | 2.036 |
| 14-749-5 |
Avenaciolide, 6-[2-(4-trifluoromethylphenyl)ethyl]-4-demethylene
|
|
5 | 2.495 |
| 15-889-9 |
Glycine, N-(3-methyl-1-oxobutyl)-, trimethylsilyl ester
|
55494-00-3 |
5 | 1.527 |
| 16-175-0 |
1,3-Propanediol, 2,2-dimethyl-, cyclic phosphorochloridate
|
|
5 | 2.406 |
| 16-369-5 |
Urea, 3-(p-fluorophenyl)-1-methyl-1-nitroso-
|
777-59-3 |
5 | 1.971 |
| 16-532-3 |
2-Deoxy-D-ribopyranose, tris(trifluoroacetate) (isomer 1)
|
|
5 | 1.786 |
| 16-855-5 |
Semicarbazide, 1-(9h-purin-6-yl)-3-thio
|
25732-31-4 |
5 | -0.969 |
| 17-259-6 |
1,1-Difluoro-2-(trans-1-propenyl)cyclopropane
|
79517-52-5 |
5 | 2.218 |
| 17-286-6 |
5-ethyl-5-methoxy-2(5 H)furanone
|
|
5 | 0.852 |
| 17-436-9 |
1-Methyl-4-nitro-5-(o-acetamidophenylsulfinyl)imidazole
|
|
5 | 1.453 |
| 17-480-0 |
Pyridinium, 3-carboxy-1-methyl-, hydroxide, inner salt
|
|
5 | -1.125 |
| 17-548-5 |
1,3-Oxathiolane, 2-ethyl-5-methyl, cis-
|
|
5 | 1.484 |
| 19-408-8 |
3-ethyl-2,5-dimethyl-5,6-dihydropyrazine
|
|
5 | 1.700 |
| 19-678-9 |
5-Ethyl-4,6-dimethyl-2-methoxy pyridine
|
|
5 | 2.269 |
| 19-753-5 |
Oxazole, 4,5-dihydro-2,4,4-trimethyl-
|
|
5 | 1.214 |
| 20-449-1 |
1,2-Dehydro-3,4-dihydro-3-hydroxydavanone
|
|
5 | 2.642 |
| 20-466-2 |
2-ethyl-3,5-dimethyl-5,6-dihydropyrazine
|
|
5 | 1.700 |
| 20-709-2 |
2,4-Pyrimidinediamine, 5-(4-chlorophenyl)-6-ethyl-
|
|
5 | 2.524 |
| 21-075-5 |
Acetophenone, 4-hydroxy-3,5-dimethoxy, O-methyloxime
|
|
5 | 1.780 |
| 22-342-7 |
Nefazodone-M (N-desalkyl-HO-) isomer-2 2AC
|
|
5 | 1.934 |
| 22-362-5 |
4,5-dihydro-5-methyl-3(2H)-thiophenone
|
|
5 | 1.081 |
| 22-449-9 |
4-Methyl-3-vinyl-3-cyclohexen-1-one
|
|
5 | 2.242 |
| 22-481-3 |
1,3-Dioxoisobenzofuran-5-carboxylic acid, trimethylsilyl ester
|
|
5 | 1.989 |
| 25-797-0 |
9-Azabicyclo[3.3.1]nonane,9-methyl-
|
491-25-8 |
5 | 2.023 |
| 26-307-2 |
2-Mercapto-3,4-dimethyl-2,3-dihydrothiophene
|
|
5 | 2.529 |
| 26-593-5 |
1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-
|
85-43-8 |
5 | 0.652 |
| 27-262-1 |
Urea, 1,1'-o-phenylenebis[3-(2-chloroethyl)-
|
|
5 | 2.407 |
| 28-479-0 |
1-Amino-4-bromo-2-anthraquinone sulfonic acid
|
116-81-4 |
5 | 2.053 |
| 28-517-7 |
Pyridazine,hexahydro-1,2,3,6-tetramethyl,cis-
|
26171-64-2 |
5 | 1.336 |
| 30-246-5 |
cis-Dihydro-3,4-diethyl-2,5-furandione
|
|
5 | 1.122 |
| 30-250-0 |
Fumaric acid, bis-(2,2,2-trifluoroethyl)ester-
|
352-28-3 |
5 | 1.754 |
| 30-499-5 |
N,N,2,2-TETRAMETHYL-1,3-PROPANEDIAMINE
|
53369-71-4 |
5 | 0.533 |
| 32-135-6 |
2,2,3-Trimethyl-3-cyclopentene-1-acetaldehyde
|
|
5 | 2.178 |
| 32-436-2 |
Ketogluconic acid methyl ester, tetrakis(trifluoroacetate) (isomer 1)
|
|
5 | 1.256 |
| 33-218-3 |
2,5-Piperazinedione, 3,6-bis(2-methylpropyl)-
|
1436-27-7 |
5 | 1.062 |
| 33-398-4 |
s-Triazine, 2-chloro-4-(isopropylamino)-6-(methylamino)-
|
3004-71-5 |
5 | 1.387 |
| 33-446-0 |
Ketogluconic acid methyl ester, tetrakis(trifluoroacetate) (isomer 3)
|
|
5 | 1.256 |
| 34-128-2 |
3-epiGA1-3-O-«beta»-D-glucopyranoside, permethyl
|
|
5 | 2.434 |
| 34-241-6 |
1,4-Dioxane-2,3-diol, chlorodifluoroacetate, trifluoroacetate
|
|
5 | 1.166 |
| 34-698-0 |
Trazodone -M (N-desalkyl-HO-) isomer-1 2AC
|
|
5 | 1.934 |
| 35-033-6 |
Urea, 1-(2-chloroethyl)-1-nitroso-3-phenyl-
|
|
5 | 2.441 |
| 35-398-2 |
3-Fluoro-5-trifluoromethylbenzoic acid, 2-methoxyethyl ester
|
|
5 | 2.648 |
| 35-927-4 |
1,3-Cyclobutanediol, 2,2,4,4-tetramethyl-
|
3010-96-6 |
5 | 0.774 |
| 36-308-0 |
cis-1,1-Difluoro-2-methyl-3-vinylcyclopropane
|
|
5 | 2.074 |
| 36-475-5 |
2(1H)Pyrimidinone,4-amino-1,N-dimethyl-
|
6220-49-1 |
5 | -0.178 |
| 36-909-3 |
Pyrimidin-4-ol, 2-dimethylamino, 5,6-dimethyl
|
|
5 | 0.865 |
| 37-308-9 |
2-Deoxy-D-ribopyranose, tris(trifluoroacetate) (isomer 2)
|
|
5 | 1.786 |
| 37-475-4 |
1,6-Anhydro-.beta.-D-glucose, tris(trifluoroacetate)
|
|
5 | 1.164 |
| 38-134-1 |
Succinic acid, 2-(dimethylamino)ethyl 4-isopropylphenyl ester
|
|
5 | 2.600 |
| 38-463-6 |
2-Propenyl 2,3-bis-(methylthio)propyl ether
|
|
5 | 2.284 |
| 39-712-8 |
2,3-Epoxy-2,4,4-trimethyl pentane
|
|
5 | 2.210 |
| 39-926-1 |
1-Azabicyclo[2.2.2]octan-3-one
|
|
5 | 0.281 |
| 40-431-8 |
1-Amino-8-naphthol-3,6-disulfonic acid
|
|
5 | 0.621 |
| 40-554-2 |
2-Pentene, 3-methoxy-4,4-dimethyl-, (Z)-
|
66017-26-3 |
5 | 2.583 |
| 41-278-8 |
1-Azabicyclo[2.2.2]octane, 4-methyl-
|
|
5 | 1.492 |
| 41-406-5 |
Sarcosine, N-(3-methylbut-2-enoyl)-, isohexyl ester
|
|
5 | 2.390 |
| 42-604-4 |
Avenaciolide, 6-[2-(4-fluorophenyl)ethyl]-4-demethylene
|
|
5 | 1.615 |
| 43-166-0 |
2,6-Pyridinedicarboxylic acid, 4-cyanophenyl ethyl ester
|
|
5 | 2.349 |
| 43-341-5 |
Cyclopentane-1-carboxylic acid, 1-ethyl, methyl ester
|
|
5 | 2.130 |
| 43-366-8 |
Oxime of 2-(n,n-dimethylthiocarbamoyl thio)-acetophenone
|
|
5 | 2.445 |
| 43-381-1 |
Ethanol, 2-[2-(9h-purin-6-ylamino)ethylthio]-
|
|
5 | 0.008 |
| 43-890-6 |
3-epi-GA1-3«alpha»-O-glucoside, permethylated
|
|
5 | 2.434 |
| 44-269-5 |
Acetamide, N-(2-iodo-4-methylphenyl)-2-acetoxy-
|
|
5 | 2.101 |
| 45-621-2 |
2,2-Dichloroethyl (E)-2-methylbut-2-enoate
|
|
5 | 2.299 |
| 45-993-0 |
Megastigma-4,6-dien-3-one, 9-hydroxy
|
|
5 | 2.629 |
| 47-666-1 |
Succinic acid, 3,5-difluorophenyl 2-methoxyethyl ester
|
|
5 | 1.840 |
| 48-173-7 |
Urea, 1-methyl, 3-[9h-purin-6-ylaminoethyl]-
|
|
5 | -0.788 |
| 48-205-1 |
l-Methionine, N-(2,6-difluorobenzoyl)-, methyl ester
|
|
5 | 1.989 |
| 48-483-3 |
3-Oxo-p-menth-1-en-7-al
|
|
5 | 1.747 |
| 49-223-0 |
3«beta»,16a-dihydroxy-5-androstene-17-one
|
|
5 | 2.070 |
| 49-676-8 |
Phosphorothioic acid, O,O-diethyl O-pyrazinyl ester
|
|
5 | 2.153 |
| 50-233-7 |
2-Pentanone, 4-methyl-3,4-bis-(methylthio)
|
|
5 | 2.449 |
| 50-601-8 |
Imidazolidin-2,4-dione, 3-(3,5-dichlorophenyl)
|
|
5 | 2.050 |
| 51-862-8 |
Acetoxyacetic acid, hex-4-yn-3-yl ester
|
|
5 | 0.895 |
| 52-258-8 |
Acetoxyacetic acid, pent-2-en-4-ynyl ester
|
|
5 | 0.282 |
| 52-264-1 |
Ketogluconic acid methyl ester, tetrakis(trifluoroacetate) (isomer 2)
|
|
5 | 1.256 |
| 52-293-9 |
2-Pentene, 3-methoxy-4,4-dimethyl-, (E)-
|
|
5 | 2.583 |
| 52-811-3 |
Barbituric acid, 5-allyl-5-(2-hydroxypropyl) permethylated
|
|
5 | 0.370 |
| 53-429-7 |
5,8-epoxy-6-megastigmen-3,9-diol
|
|
5 | 1.632 |
| 53-523-2 |
(+)-Jasmonic acid - (S)-Val conjugate, methyl ester
|
|
5 | 2.642 |
| 53-567-4 |
Maleic acid, bis(2,2,2-trifluoroethyl) ester
|
|
5 | 1.754 |
| 54-142-4 |
trans-Dihydro-3,4-diethyl-2,5-furandione
|
|
5 | 1.122 |
| 54-487-2 |
2,3,6-Trimethyl-1,4-diacetylglucoside (B)
|
|
5 | -0.118 |
| 55-045-1 |
(E)(1-Propenyl) (2-methyl-1-propenyl)ether
|
|
5 | 2.460 |
| 55-106-3 |
2-Carboxymethyl-oxirane-2-carboxylic acid methyl ester
|
|
5 | -0.597 |
| 55-778-8 |
Carbonic acid, ethyl 2-nitro-5-fluorophenyl ester
|
|
5 | 2.269 |
| 57-215-0 |
Pyridazine,hexahydro-1,2,3,6-tetramethyl,trans-
|
38704-91-5 |
5 | 1.336 |
| 57-650-7 |
1,4-Phthalazinedione, 5-amino-2,3-dihydro-
|
|
5 | -1.165 |
| 57-847-9 |
3-propyl-2,5-dimethyl-5,6-dihydropyrazine
|
|
5 | 2.091 |
| 58-038-6 |
3-Cyclohexen-1-one, 2-isopropyl-5-methyl-
|
|
5 | 2.424 |
| 58-837-9 |
4-oxo-3,4-dihydro-2,3-diazaphenoxathiin
|
|
5 | 1.024 |
| 59-269-9 |
2,4-Diaminophenol, N2,N4,N4,O-tetraacetyl-
|
|
5 | 1.470 |
| 59-350-8 |
1,4,6,9-Tetrathiaspiro[4.4]nonane
|
|
5 | 2.558 |
| 59-825-1 |
2-(3,5-Dimethylpyrazol-1-yl)-1H-benzimidazole
|
|
5 | 1.884 |
| 60-471-2 |
4-iodo-2,5-dimethoxy-«beta»-phenethylamine, TFA
|
|
5 | 2.529 |
| 60-639-6 |
3-methyl-2-oxo-2,5-dihydro-thiophene
|
|
5 | 1.206 |
| 60-812-3 |
(9R)-9-Hydroxy-4-7E-megastigmadien-3-one
|
|
5 | 2.485 |
| 61-599-0 |
4-Ethyl-4-hydroxymethyl-2-methyl-delta^2-oxazoline
|
19383-04-1 |
5 | 0.576 |
| 62-355-9 |
2-Propenethioamide, 2-cyano-3-(4-fluorophenyl)-, (E)-
|
68029-40-3 |
5 | 2.019 |
| 62-604-2 |
4-CHLORO-1-AZABICYCLO[2.2.2]OCTANE
|
|
5 | 1.464 |
|
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