| ID | Name | CAS | Data |
McVol (ml/mol) |
| 19-847-1 |
9H-purine-6(1h)-one, 2-amino-9-ethyl-
|
|
2 | 126.340 |
| 20-430-1 |
2,2'-Azo-1,3,4-thiadiazol-5-one
|
|
2 | 128.320 |
| 20-873-0 |
1H-1,2,4-Triazol-5-amine, 1-propyl-
|
58661-96-4 |
2 | 101.770 |
| 21-082-7 |
1H-1,2,4-Triazol-5-amine, 1-ethyl-
|
|
2 | 87.680 |
| 21-313-0 |
Pyrimidine, 5-amino-6-chloro-2-ethyl-4-ethylamino-
|
6237-98-5 |
2 | 151.980 |
| 21-481-4 |
Acetamide, n-(5,7-difluoro-1h-benzotriazol-4-yl)-
|
|
2 | 129.690 |
| 21-871-1 |
2,4-DIACETOXY-10-CYANOAZULENO(2,1-B)PYRIDINE
|
|
2 | 228.040 |
| 24-027-5 |
5-Methyl-7-oxo-1,2,3a,4-tetrazaindene
|
|
2 | 102.270 |
| 24-328-1 |
Ethanol, 2-[(6-amino-5-nitro-4-pyrimidinyl)thio]-
|
|
2 | 141.220 |
| 26-392-8 |
9H-purin-6(1h)-one, 9-benzyl-2-dimethylamino-
|
|
2 | 201.210 |
| 27-102-8 |
Isonipecotic acid, N-(3-fluoro-5-trifluoromethylbenzoyl)-, decyl ester
|
|
2 | 340.470 |
| 27-553-8 |
2,4-Dinitrophenylhydrazone of 1-n-hexylsulfonyl-2-propanone
|
97498-49-2 |
2 | 277.040 |
| 27-773-4 |
2-Pyrimidinesulfonic acid, 4,6-diaminothio-, s-trichloromethyl ester
|
|
2 | 178.630 |
| 28-333-1 |
P-(1h-1,2,4-triazol-1-yl) phenol
|
|
2 | 116.170 |
| 28-878-7 |
2-Pyrimidinamine, 4,6-dimethyl-N-trifluoroacetyl-N-phenyl-
|
|
2 | 197.420 |
| 29-456-4 |
.alpha.-[6-AMINO-9H-PURIN-9-YL]-p-TOLUENESULFONAMIDE
|
|
2 | 205.230 |
| 30-093-5 |
Pyrimidine, 6-amino-4-benzyl(cyano)amino-2-benzylthio-
|
|
2 | 264.940 |
| 30-466-1 |
Nicotinonitrile, 2-chloro-6-methyl-5-nitro-4-(trifluoromethyl)-
|
|
2 | 146.150 |
| 31-724-3 |
p-Toluenesulfonamide, alpha-[6-(methylthio)-9H-purin-9-yl]-
|
21268-01-9 |
2 | 225.690 |
| 32-566-8 |
O-(2,4,6-trichlorophenyl)-n-methylamido-n-ethylamidothiophosphate
|
114133-84-5 |
2 | 213.270 |
| 35-244-2 |
2-(2-Methyl-6-ethylphenoxy)-3-(5-nonyl) pyrazine
|
116668-93-0 |
2 | 299.150 |
| 35-489-1 |
4-Chloro-6-methyl-1,3,3a,7-tetrazaindene
|
|
2 | 108.640 |
| 36-778-9 |
Hexanal, 4-oxo-6-methylpyrimidin-2-ylhydrazone (keto form)
|
|
2 | 183.580 |
| 36-884-1 |
1-(1-Pyrrolidinyl)-2,2-diphenyl-3-(phenylacetamido)propane
|
|
2 | 330.680 |
| 38-569-9 |
9H-purine-9-acetamide, 1,6-dihydro-6-thioxo-
|
|
2 | 138.390 |
| 39-357-3 |
Acetic acid, [p-[3-(2-chloroethyl)-3-nitrosoureido]phenylthio]-
|
|
2 | 211.200 |
| 39-477-0 |
4-Methyl-6-oxo-1,3,3a,7-tetrazaindene
|
|
2 | 102.270 |
| 40-359-9 |
2,4-Dinitrophenylhydrazone of 1-n-pentanesulfonyl-2-propanone
|
97172-82-2 |
2 | 262.950 |
| 40-373-3 |
1,1-Diphenyl-2(n-methyl-n'-piperazino) ethanol
|
21579-78-2 |
2 | 246.020 |
| 40-512-8 |
1-(1-Pyrrolidinyl)-2,2-diphenyl-3-(acetamido)propane
|
116595-09-6 |
2 | 269.900 |
| 41-042-9 |
(Oxazolidin-2-one-3-methyl)cyclohexane, 1,4-bis-
|
|
2 | 210.380 |
| 43-410-8 |
c-OP{N(CH3)2}N(CH3)CH2CH2N(CH3)
|
|
2 | 140.810 |
| 43-853-7 |
Purin-8(9h)-one, 6-amino-7-(2-hydroxyethyl)-
|
|
2 | 132.210 |
| 45-023-6 |
3-(N-methylanilino)-2-methyl-5-(5-nonyl) pyrazine
|
|
2 | 289.170 |
| 47-834-4 |
1,4-Piperazinediacetonitrile, alpha,alpha',2,5-tetramethyl-,trans-
|
|
2 | 191.800 |
| 47-909-1 |
Acetic acid, 5-amino-6-chloro-4-pyrimidinyl hydrazide
|
7597-91-3 |
2 | 135.350 |
| 48-350-0 |
Acetamide, n-[9h-purin-6(1h)-thione-9-yl]-
|
|
2 | 138.390 |
| 51-993-3 |
Imidazole-5-formamide, n,1-dibenzyl-4-(n-benzylformamido)-
|
7026-46-2 |
2 | 329.520 |
| 52-128-2 |
Imidazole-4-carboxamide, 5-(3,3-dimethyl-1-triazeno)-
|
4342-03-4 |
2 | 133.090 |
| 53-169-6 |
Urea, 1-[2-[9h-(purin-6-yl)thio]ethyl]-
|
90953-43-8 |
2 | 162.460 |
| 55-092-9 |
Urea, 1-methyl-3-[2-(purin-8-ylthio)ethyl]-
|
|
2 | 176.550 |
| 57-803-7 |
9H-purine-9-acetic acid, 6-chloro-, ethyl ester
|
|
2 | 158.350 |
| 58-772-1 |
Succinic acid, 2-[4(5)-nitroimidazol-5(4)-carboxamido]-
|
|
2 | 167.930 |
| 58-927-9 |
5.alpha.-Pregnan-3,20-dione, MO, # 2
|
|
2 | 300.500 |
| 60-123-8 |
5.alpha.-Pregnan-3,20-dione, MO, # 1
|
|
2 | 300.500 |
| 61-460-3 |
1,2,3-Benzotriazine-4(3h)-one, 6-chloro-
|
37429-97-3 |
2 | 114.320 |
| 62-063-3 |
1,2,5-Thiadiazole-3-carboxamide, 4-(3-ethylureido)-
|
|
2 | 145.330 |
| 62-901-2 |
Formimidic acid, n-6-(chloropurin-2-yl), ethyl ester
|
|
2 | 148.370 |
| 65-404-1 |
4-Imidazolecarboxylic acid, 5-(dibutyl-1-triazeno)-, methyl ester
|
|
2 | 227.610 |
| 67-178-1 |
4-Hydrazino-6-methyl-1,3,3a,7-tetrazaindene
|
37140-08-2 |
2 | 116.360 |
| 68-957-5 |
Isonipecotic acid, N-(3-fluoro-4-trifluoromethylbenzoyl)-, dodecyl ester
|
|
2 | 368.650 |
| 69-588-4 |
2-([Bis(2-naphthyloxy)phosphoryl]oxy)-1,1'-biphenyl
|
116401-99-1 |
2 | 371.720 |
| 70-043-6 |
2-Deoxy-D-ribose, tris(trifluoroacetate), methyloxime (isomer 1)
|
|
2 | 229.740 |
| 70-241-6 |
1H-1,2,4-Triazol-3-amine, 1-propyl-
|
|
2 | 101.770 |
| 72-111-8 |
Flavone-3-rutinoside, 3,3',4',5,7-pentahydroxy
|
153-18-4 |
2 | 396.510 |
| 72-960-6 |
Pyrimido[5,4-e]-as-triazine-5(6h)-thione
|
|
2 | 104.340 |
| 76-414-8 |
Phosphoric acid, dimethyl 3-methyl-4-(methylsulfonyl)phenyl ester
|
|
2 | 200.030 |
| 77-211-2 |
1,2,3,4-Tetrahydropyrido-[1,2-a] benzimidazole
|
|
2 | 136.030 |
| 77-378-8 |
Bis(3,5-dimethylphenyl)-2-ethyl-4-methylpentyl phosphate
|
116402-05-2 |
2 | 345.440 |
| 77-558-8 |
Pyrrolidine, 1,5-dimethyl-2-ethylidene-3,3-diphenyl
|
|
2 | 239.960 |
| 78-114-9 |
5-Propionyl-7-methyl-2,3-dihydro-1H-pyrrolizine
|
|
2 | 147.080 |
| 78-251-7 |
Pyridine, 2,6-diamino-4-[(diphenylmethyl)amino]-3-nitro-
|
|
2 | 250.540 |
| 78-848-5 |
Pyrimidine, 2,5-bis(trifluoroacetamido)-4,6-bis(methylthio)-
|
|
2 | 214.380 |
| 79-557-7 |
Pyridine, 3-(1-buten-1-yl)-4-propyl, (Z)-
|
|
2 | 161.860 |
| 79-987-0 |
2-(P-nonylphenoxy)-3-methyl-6-(5-nonyl) pyrazine
|
|
2 | 397.780 |
| 80-837-4 |
Pyrimido [5,4-e]-as-triazine, 1,2-dihydro-
|
|
2 | 92.290 |
| 81-001-0 |
2-Amino-5-tert-butyl-1,3,4-thiadiazole
|
39222-73-6 |
2 | 122.230 |
| 85-091-7 |
Butric acid, 2-benzamido-4[(carboxymethyl)thio]-, dimethyl ester
|
|
2 | 241.230 |
| 85-632-6 |
Formamide, n-[4-amino-6-(benzylthio)pyrimidin-5-yl]-
|
|
2 | 190.260 |
| 85-922-4 |
4-Morpholino-6-methyl-1,3,3a,7-tetrazaindene
|
78666-95-2 |
2 | 157.750 |
| 85-973-8 |
2,3-Dihydro-ih-pyrrolo[1,2-a] benzimidazole
|
|
2 | 121.940 |
| 86-454-3 |
3-Benzofurancarboxamide, n-cycloheptyl-2,3-dihydro-3-phenyl-
|
95133-29-2 |
2 | 269.020 |
| 89-558-5 |
3-(N-methylanilino)-2-methyl-5-(n-heptyl)pyrazine
|
|
2 | 260.990 |
| 89-630-4 |
Adenine, n-[2-[[2-(p-tolylthio)ethyl]thio]ethyl]-
|
|
2 | 256.220 |
| 90-732-9 |
2-(N,n-di-n-butylamino)-3-methyl pyrazine
|
|
2 | 200.210 |
| 91-758-0 |
3,4-(2'-METHYL-2'METHOXY-4'-PHENYL)-DIHYDROPYRANCUMARINE
|
|
2 | 238.300 |
| 92-127-9 |
1,3-Propanediol, 2,2-dimethyl-, cyclic chloromethyl phosphonate
|
|
2 | 134.850 |
| 94-136-7 |
9H-purine-6(1h)-thione, 2-amino-9-benzyl-
|
|
2 | 183.510 |
| 94-235-7 |
Triazolo [4,5-d] pyrimidine, 3h-v-, 7-(octyloxy)-
|
|
2 | 196.790 |
| 94-443-6 |
3,3'-Ethylene bis-(4-methyl-2-thiazole)-thione
|
|
2 | 193.900 |
| 94-521-9 |
2-(2,2,4-Trimethylpentoxy)-3-(5-nonyl) pyrazine
|
5008-90-2 |
2 | 308.820 |
| 96-114-9 |
Phosphonic acid, phenyl-, bis(2-ethyl-4-methylpentyl) ester
|
|
2 | 335.150 |
| 96-762-0 |
Formamide, n-(4-amino-2,6-dichloro-5-pyrimidinyl)-
|
|
2 | 123.520 |
| 96-901-5 |
4-Methyl-6-oxo-1,2,3a,7-tetrazaindene
|
69924-53-4 |
2 | 102.270 |
| 96-903-3 |
6-Methyl-4-oxo-1,3,3a,7-tetrazaindene
|
35523-67-2 |
2 | 102.270 |
| 98-419-9 |
Imidazole-5(4)-carboxamide, n-methyl-4(5)-nitro-
|
57445-42-8 |
2 | 110.780 |
| 98-612-4 |
6-Methyl-4-oxo-1,2,3a,7-tetrazaindene
|
|
2 | 102.270 |
| 98-614-2 |
2-Pyrimidinecarbamonitrile, 1,6-dihydro-4-methyl-6-oxo-
|
|
2 | 108.830 |
| 113-183-3 |
As-triazine-6-carboxylic acid, 3-amino-5-hydroxy-
|
116496-93-6 |
2 | 96.690 |
| 115-705-1 |
Formamide, n-(2,4-diamino-6-chloro-5-pyrimidinyl)-
|
171887-09-5 |
2 | 121.260 |
| 115-752-9 |
Thiosulfuric acid, s-[2-[(2-anilinoethyl)amino]ethyl]ester
|
|
2 | 198.270 |
| 116-719-5 |
4(3H)-pteridinone, 2-amino-6-(diethoxymethyl)- (keto form)
|
|
2 | 190.140 |
| 117-453-9 |
4(3H)-pyrimidinone, 6-amino-2-chloro-5-nitro-
|
|
2 | 108.930 |
| 118-889-5 |
Anthranilic acid, n-[(2-thioxo-benzothiazolin-3-yl)methyl]-
|
73791-26-1 |
2 | 219.630 |
| 120-033-1 |
1-Phenyl-2-acetyl-4,4-dimethyl-3-pyrazolidone
|
86475-37-8 |
2 | 182.510 |
| 121-009-7 |
Purine-6(1h)-one, 1-[2-(p-tolythio)ethyl]-
|
7702-67-2 |
2 | 207.580 |
| 121-037-6 |
2-(2,2,4-Trimethylpentoxy)-3,6-dimethyl pyrazine
|
|
2 | 210.190 |
| 123-093-2 |
5-Benzofuranol, 2-piperidino-2,3-dihydro-3-ethyl-
|
|
2 | 198.450 |
| 123-410-9 |
2-(2,2,4-Trimethylpentoxy)-3-(n-pentyl) pyrazine
|
|
2 | 252.460 |
| 14-000-5 |
Anthracene, 1,2,3,4,5,6,7,8-octahydro-
|
1079-71-6 |
34 | 162.640 |
|
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