| ID | Name | CAS | Data |
logPoct/wat |
| 36-375-6 |
Formamidine, 3,3-dimethyl-1-(4-bromophenyl)
|
|
5 | 2.670 |
| 36-984-0 |
But-1-ene-3-yne, 1-ethoxy-
|
2806-41-9 |
5 | 1.170 |
| 37-321-4 |
Barbituric acid, 5-methyl-5-phenyl perethylated
|
|
5 | 1.775 |
| 37-384-5 |
Thioxanthene-3,7-diamine, 10,10-dioxide
|
|
5 | 1.588 |
| 38-180-0 |
D-(+)-Mannopyranose, pentakis(trifluoroacetate) (isomer 2)
|
|
5 | 2.345 |
| 38-181-9 |
2-Isopropylidene-3-methylhexa-3,5-dienal
|
|
5 | 2.654 |
| 38-783-1 |
Methanimine, 1-(4-morpholino), N-(4-methoxyphenyl)
|
|
5 | 1.687 |
| 39-288-0 |
Benzeneamine, 4-(1-morpholinyl)-N,N'-dimethyl-
|
|
5 | 1.589 |
| 39-296-1 |
Benzamide, N-tetrahydrofurfuryl-2,3,4-trifluoro-
|
|
5 | 2.013 |
| 39-393-3 |
trans,cis-2,3,5-trimethyl-thiacyclopentane
|
|
5 | 2.536 |
| 40-042-0 |
D-(+)-Galactopyranose, pentakis(trifluoroacetate) (isomer 1)
|
|
5 | 2.345 |
| 40-404-8 |
D-(+)-Xylopyranose, tetrakis(trifluoroacetate) (isomer 2)
|
|
5 | 1.871 |
| 40-664-0 |
Isonipecotic acid, N-(3-fluorobenzoyl)-, ethyl ester
|
|
5 | 2.241 |
| 41-074-4 |
Isonipecotic acid, N-(3-chloropropionyl)-, butyl ester
|
|
5 | 2.197 |
| 41-464-1 |
1H-Pyrrole, 4-ethyl-2,3-dimethyl-
|
491-18-9 |
5 | 1.712 |
| 41-484-9 |
l-Valine, N-(3-cyclopentylpropionyl)-, methyl ester
|
|
5 | 2.271 |
| 41-495-7 |
3-Acetoxy-2-methyl-pyran-4-one
|
|
5 | 0.874 |
| 41-797-2 |
Benzenesulfonamide, 5-amino-2-methyl-N-phenyl-
|
79-72-1 |
5 | 2.378 |
| 42-032-9 |
L-(+)-Threose, tris(trifluoroacetate) (isomer 3)
|
|
5 | 1.396 |
| 42-181-4 |
Cyclohexanemethanamine, 4-amino-.alpha.,.alpha.,4-trimethyl-
|
|
5 | 1.631 |
| 42-934-8 |
Octanoic acid, 2,3-epoxy-, methyl ester
|
116663-03-7 |
5 | 1.507 |
| 43-063-4 |
Isonipecotic acid, N-(3-methylbutyryl)-, propyl ester
|
|
5 | 2.224 |
| 43-455-9 |
Isonipecotic acid, N-(3-chloropropionyl)-, isobutyl ester
|
|
5 | 2.053 |
| 43-870-8 |
3-epi-GA1-13-O-glucoside, permethylated
|
|
5 | 2.434 |
| 44-023-7 |
(-)-Jasmonic acid - (R)-Val conjugate, methyl ester
|
|
5 | 2.642 |
| 44-219-0 |
1H-Pyrrole, 3-ethyl-2,5-dimethyl-
|
69687-78-1 |
5 | 1.712 |
| 44-724-9 |
2,2,4-Trimethyl-1,3-dithiolane
|
|
5 | 2.591 |
| 45-448-5 |
D-(+)-Mannopyranose, pentakis(trifluoroacetate) (isomer 1)
|
|
5 | 2.345 |
| 45-702-2 |
Isonipecotic acid, N-(5-chlorovaleryl)-, propyl ester
|
|
5 | 2.587 |
| 45-819-3 |
N-methyl, N-ethyl-2-aminoethanol, TMS
|
|
5 | 1.790 |
| 46-637-4 |
(CH3)2N-C(C2H5)=N(n-C5H11)
|
107322-35-0 |
5 | 2.547 |
| 46-666-2 |
Hydrocinnamamide, 2,3,4,5,6-pentafluoro-
|
1994-24-7 |
5 | 1.800 |
| 46-749-0 |
2-Propionyl-1,4,5,6-tetrahydropyridine
|
80933-74-0 |
5 | 1.233 |
| 46-829-1 |
2H-1,4-Ethanoquinoline, 3,4-dihydro-
|
4363-25-1 |
5 | 2.384 |
| 47-275-5 |
(+)-1-Hydroxymethyl- pyrrolizidine butanoic acid ester
|
|
5 | 1.814 |
| 47-913-6 |
D-«alpha»-Cyclohexylglycine, N-chlorodifluoroacetyl-, ethyl ester
|
|
5 | 2.446 |
| 48-204-2 |
cis,trans-2,3,5-trimethyl-thiacyclopentane
|
|
5 | 2.536 |
| 49-346-4 |
PHOSPHOROTHIOIC ACID, O,O,O-TRIMETHYL ESTER
|
|
5 | 1.150 |
| 49-348-2 |
3-Hexene, 3-methoxy-2-methyl-, (E)-
|
|
5 | 2.583 |
| 50-969-1 |
D-(+)-Galactofuranose, pentakis(trifluoroacetate) (isomer 2)
|
|
5 | 2.345 |
| 51-471-2 |
N,n'-ethylene bis(a,a-dichloropropionamide)
|
|
5 | 1.606 |
| 51-668-4 |
Methanimine, 1-(1-pyrrolidinyl), N-(4-methoxyphenyl)
|
|
5 | 2.451 |
| 51-815-0 |
GA29-2-O-«beta»-D-glucopyranoside, permethyl
|
|
5 | 2.434 |
| 52-079-7 |
D-(+)-Glucose, pentakis(trifluoroacetate) (isomer 1)
|
|
5 | 2.345 |
| 53-235-2 |
Spiro[3.3]hepta-1,5-diene
|
22635-78-5 |
5 | 1.893 |
| 53-896-9 |
Spiro(1,2-dithiolane-4,5'-hydantoin)
|
62032-12-6 |
5 | -0.040 |
| 54-226-1 |
2-Acetyl-4,5-dimethyl-2-thiazoline
|
|
5 | 1.498 |
| 55-297-2 |
3-Hexene, 3-methoxy-2-methyl-, (Z)-
|
|
5 | 2.583 |
| 55-335-9 |
Isonipecotic acid, N-(3-chloropropionyl)-, pentyl ester
|
|
5 | 2.587 |
| 55-732-8 |
5,5-dimethyl-4-thia-1-heptyne
|
|
5 | 2.541 |
| 56-210-6 |
D-(+)-Xylofuranose, tetrakis(trifluoroacetate) (isomer 1)
|
|
5 | 1.871 |
| 56-274-6 |
(S)-2-Butyl glucuronide, methyl ester, triacetate
|
|
5 | 0.494 |
| 56-480-7 |
1-Propene, 1,1'-oxybis-, (E,Z)-
|
4696-29-1 |
5 | 2.070 |
| 56-754-3 |
(-)-Jasmonic acid - (S)-Ala conjugate, methyl ester
|
|
5 | 2.006 |
| 56-803-8 |
3-ethyl-1,2-dithiolan-4-one
|
|
5 | 1.729 |
| 58-106-0 |
Pyrazine, 2-(2-furfuryl)-3,6-dimethyl
|
|
5 | 2.277 |
| 58-557-0 |
D-(-)-Quinic acid, tetramethyl ether, methyl ester
|
|
5 | 0.383 |
| 59-154-6 |
(-) Jasmonic acid - (S)-Val conjugate, methyl ester
|
|
5 | 2.642 |
| 59-273-4 |
2,5-Di hydroxyphenylacetic acid, TFA-ME
|
|
5 | 2.337 |
| 59-502-9 |
GA1-3-O-«beta»-D-glucopyranoside, permethyl
|
|
5 | 2.434 |
| 59-918-8 |
P-phthalaldehydic acid 2,4-dinitro-phenylhydrazone
|
|
5 | 2.647 |
| 60-479-4 |
D-Pro, N-ethoxycarbonyl, (S)-1-phenylethylamide
|
|
5 | 2.485 |
| 60-590-0 |
3,3,4,5-tetramethylcyclohexan-1-one
|
|
5 | 2.648 |
| 60-849-3 |
Acetoacetamide, n-(1,1,3,3-tetramethylbutyl)-
|
|
5 | 2.296 |
| 61-143-5 |
N,N-Dimethyl-N'-propyl-p-methoxybenzamidine
|
|
5 | 2.413 |
| 61-232-6 |
Fumaric acid, monoamide, N-allyl-, pentafluorobenzyl ester
|
|
5 | 2.284 |
| 61-326-2 |
Pyruvic acid, 9h-purin-6-yl-hydrazone
|
|
5 | -0.257 |
| 61-717-8 |
GA5-13-O-«beta»-D-glucopyranoside, permethyl
|
|
5 | 2.585 |
| 61-961-7 |
2(1H)-Pyridinethione, 3-hydroxy-6-methyl-
|
|
5 | 1.384 |
| 62-711-3 |
2-Ethyl-2-methyl-1,3-dithiolane
|
6008-81-7 |
5 | 2.593 |
| 62-727-6 |
Benzoic acid, p-(3-methyl-3-nitrosoureido)-
|
90349-65-8 |
5 | 1.530 |
| 63-843-6 |
GA1-13-O-«beta»-D-glucopyranoside, permethyl
|
|
5 | 2.434 |
| 63-919-2 |
Ethanamine, 1,1-dimethyl, N-(1-methylethyl)
|
|
5 | 1.783 |
| 64-197-3 |
N-cyclopropyl-3,4,5-tri-methoxybenzamide
|
92042-04-1 |
5 | 1.605 |
| 64-439-4 |
N-ethyl, N-isopropyl-2-aminoethanol, TMS
|
|
5 | 2.568 |
| 65-849-8 |
L-Pro, N-ethoxycarbonyl, (S)-1-phenylethylamide
|
|
5 | 2.485 |
| 66-083-7 |
L-(+)-Rhamnopyranose, tetrakis(trifluoroacetate) (isomer 1)
|
|
5 | 2.259 |
| 66-189-0 |
(-)-Jasmonic acid, (S)-Asp conjugate, methyl ester
|
|
5 | 0.861 |
| 67-153-8 |
4,4'-Azobis(4-cyano-1-pentanol)
|
|
5 | 1.548 |
| 67-905-3 |
4-Piperidinamine, 2,2,6,6-tetramethyl-
|
|
5 | 1.254 |
| 67-909-9 |
D-(+)-Glucose, pentakis(trifluoroacetate) (isomer 2)
|
|
5 | 2.345 |
| 67-910-7 |
L-(+)-Rhamnopyranose, tetrakis(trifluoroacetate) (isomer 2)
|
|
5 | 2.259 |
| 68-082-6 |
2-Ethyl-4,4-dimethyl-2-oxazoline
|
|
5 | 1.604 |
| 68-802-6 |
D-(+)-Talofuranose, pentakis(trifluoroacetate) (isomer 2)
|
|
5 | 2.345 |
| 69-208-5 |
2,6-Pyridinedicarboxylic acid, isobutyl isopropyl ester
|
|
5 | 2.460 |
| 69-312-9 |
3(2H)-Furanone, 2-acetyl-4-hydroxy
|
|
5 | -0.057 |
| 70-102-0 |
cis,cis-2,3,5-trimethyl-thiacyclopentane
|
|
5 | 2.536 |
| 70-186-8 |
GA8-2-O-«beta»-D-glucopyranoside, permethyl
|
|
5 | 2.059 |
| 70-786-2 |
DL-Norepinephrine, N,N-dimethyl-, trimethyl ether
|
|
5 | 1.953 |
| 71-378-4 |
5-Methyl-4-hydroxy-3(2H)-furanone
|
|
5 | 0.375 |
| 71-654-7 |
1,2-dimethyl-3-(1-methylethenyl) cyclopentanol
|
72402-00-7 |
5 | 2.360 |
| 73-055-0 |
Furan, 2,3-dihydro-2,5-dimethyl-
|
17108-52-0 |
5 | 1.699 |
| 74-002-7 |
Alpha-benzamido-4-hydroxy-3,5-diiodohydrocinnamamide
|
195067-02-8 |
5 | 2.428 |
| 74-910-9 |
Cyclopentaneacetaldehyde, 2-formyl-3-methyl-«alpha»-methylene-
|
5951-57-5 |
5 | 1.603 |
| 75-319-5 |
2-Methyl-2-ethyl-3-hydroxyhexyl propionate
|
|
5 | 2.517 |
| 75-395-1 |
«beta»-D-Glucopyranose, 1,6-anhydro-, triacetate
|
13242-55-2 |
5 | -0.463 |
| 75-615-6 |
Benzamide, 3-chloro-2-fluoro-N-propyl-
|
|
5 | 2.619 |
| 75-655-2 |
2,3-dimethyl-4-isopropenyl-1-cyclopentanone
|
|
5 | 2.424 |
| 75-661-5 |
2-Methyl-4-(1-methylethyl)-2-cyclohexenone
|
41469-46-9 |
5 | 2.568 |
| 75-674-1 |
2,6,6-Trimethylcyclohexa-1,4-dienecarbaldehyde
|
162376-82-1 |
5 | 2.488 |
|
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