| ID | Name | CAS | Data |
McVol (ml/mol) |
| 65-479-9 |
Formamide, n-[4-amino-6-(benzylthio)-5-pyrimidinyl]-n-benzyl-
|
7461-79-2 |
2 | 265.130 |
| 65-737-2 |
4-Hydroxy-3,4,5,5-tetra-methylthiazolidine-2-thione
|
|
2 | 142.880 |
| 65-769-7 |
Purin-6(1h)-one, 2-chloro-8-chloromethyl-7-methyl-
|
46292-82-4 |
2 | 140.840 |
| 66-165-6 |
Malonic dilactone, alpha-[2-(morpholino)ethyl]-cis-1(me),3(h),4(h)-cis-3(h)-1,8-dihydroxy-3-p-menthyl
|
|
2 | 265.860 |
| 66-351-9 |
N-[4-(6-methyl)-1,3,3a,7-tetrazaindenyl]-ethylenediamine hydrochloride
|
|
2 | 144.540 |
| 66-352-8 |
1,2,3-Benzotriazine-4-(3h)-one, 6,8-dichloro-
|
60233-65-0 |
2 | 126.560 |
| 66-378-0 |
2,4(1H,3H)-Pyrimidinedione, 5-[bis(2-chloroethyl)amino]-
|
|
2 | 165.980 |
| 66-479-8 |
Formamide, n-[4-amino-2,6-bis-(methylthio)-5-pyrimidinyl]-
|
7595-53-1 |
2 | 159.920 |
| 66-521-0 |
[1,2,5]Thiadiazolo[3,4-d]pyrimidine, 5-amino-7-butylamino-
|
|
2 | 160.890 |
| 68-352-6 |
2,4-Imidazolidinedione, 1,3-bis(chloromethyl)-5,5-dimethyl-
|
116401-49-1 |
2 | 146.210 |
| 68-804-4 |
Imidazole-4-carboxylic acid, 5-(3-cyclohexyl-3-methyl-1-triazeno)-, 2-(diethylamino)ethyl ester
|
36142-60-6 |
2 | 283.090 |
| 68-917-9 |
Acetic acid, [3-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)ureido]- ethyl ester
|
7154-16-7 |
2 | 174.580 |
| 69-036-6 |
S-Triazolo(1,5-A)pyrimidine, 5-methyl-7-ethylamino-
|
|
2 | 134.560 |
| 69-115-8 |
2,3,4,5,7,8,9,10,11,12-Decahydro-1H-6,12a-diaza-cyclohepta[4,5]benzo[1,2]cycloocten-13-one
|
|
2 | 202.560 |
| 69-177-0 |
Urea, 1-methyl-1-nitroso-3-[2-(9h-purine-6-ylthio)ethyl]-
|
90642-35-6 |
2 | 188.100 |
| 72-345-9 |
1H-naphth[1,2-d]imidazole, 1-(p-anisidino)-2-phenyl-
|
13750-96-4 |
2 | 278.930 |
| 72-380-0 |
3-(N,n-di-n-hexylamino)-2-methyl-5-(n-heptyl)-pyrazine
|
116403-06-6 |
2 | 355.200 |
| 72-398-1 |
Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form)
|
|
2 | 368.160 |
| 72-408-9 |
2-(N,n-di-n-pentylamino)-3-methyl-6-(n-heptyl) pyrazine
|
116402-83-6 |
2 | 327.020 |
| 72-590-7 |
2-(N,n-di-n-butyl amino)-3-(5-nonyl) pyrazine
|
|
2 | 312.930 |
| 73-200-8 |
V-triazolo[5,4-d]-v-triazin-7(6h)-one
|
4730-53-4 |
2 | 79.960 |
| 73-716-6 |
1H-naphth[1,2-d]imidazole, 1-(p-bromoanilino)-2-(p-nitrophenyl)-
|
14135-28-5 |
2 | 293.890 |
| 73-718-4 |
3H-naphth[1,2-d]imidazole, 3-(p-nitroanilino)-2-(p-nitrophenyl)-
|
|
2 | 293.810 |
| 73-864-2 |
N,n'-bis-(4-(6-methyl)1,3,3a,7-tetrazaindenyl)-hexamethylenediamine
|
|
2 | 286.440 |
| 73-865-1 |
2-Pyridinecarbamic acid, 6-amino-4-[[2-hydroxy-3-(methylphenylamino)propyl]amino]-5-nitro-, ethyl ester
|
|
2 | 297.590 |
| 74-115-2 |
N-beta-hydroxyethyl-n,n'-bis-(4-(6-methyl)-1,3,3a,7-tetrazaindenyl)ethylenediamine
|
111472-54-9 |
2 | 264.130 |
| 74-187-3 |
N,n'-bis-(4-(6-methyl)1,3,3a,7-tetrazaindenyl)-ethylenediamine
|
100883-07-6 |
2 | 230.080 |
| 74-407-8 |
5,5'-Methylene-bis(2-keto-1,3-dimethyltetrahydro-1,3,5-triazine
|
126591-36-4 |
2 | 207.150 |
| 74-769-7 |
Cyclohexanecarboxylic acid, 1-[3-(2-chloroethyl)ureido]-3-methyl-, ethyl ester
|
33190-16-8 |
2 | 224.380 |
| 74-829-0 |
Urea,] 1,1'-trimethylenebis[3-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-
|
96432-16-5 |
2 | 252.970 |
| 75-376-2 |
Oxadiazole, 1,2,4-, 5-(3-chlorophenyl)-3-(5-nitrofuran-2-yl)-
|
5671-09-0 |
2 | 178.620 |
| 75-614-7 |
9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 3',5'-cyclic phosphate
|
20096-88-2 |
2 | 203.070 |
| 77-408-4 |
N,n'-bis-(4-(6-methyl)1,3,3a,7-tetrazaindenyl)-4,4'-biphenyldiamine
|
|
2 | 323.460 |
| 78-450-6 |
3H-v-triazolo[4,5-d]pyrimidine, 5-amino-3-butyl-7-hydroxy-
|
|
2 | 300.820 |
| 80-123-6 |
2,11-Dibenzylbenzo[b]dipyrido[3,2,1-de:1,2,3-mn]-phenazine-1,12-dione
|
105564-86-1 |
2 | 385.520 |
| 80-357-7 |
Oxadiazole, 1,2,4-, 5-(alpha-bromopentadecyl)-3-(5-nitrofuran-2-yl)-
|
|
2 | 334.450 |
| 80-454-9 |
2,6-Methano-1,4(2h)-benzoxazocin, 4(3h)-cyclopropyl-6(5h)-phenyl-
|
|
2 | 228.410 |
| 80-627-7 |
5,8-Dihydro-2-methyl-3-(1-phenyl-5-tetrazolylthio)-5,8-ethano-1,4-naphthohydroquinone
|
|
2 | 267.670 |
| 80-730-2 |
Thiadiazolo[3,4-d]pyrimidine-5-thiol, 1,2,5-, 7-amino-
|
90773-36-7 |
2 | 110.900 |
| 80-758-2 |
Triazolo[4,5-d]pyrimidine, 1h-v-, 5,7-dichloro
|
|
2 | 102.680 |
| 81-026-3 |
Urea, n-(2-chloroethyl)-n-nitroso-n'-(5-nitrothiazol-2-yl)-
|
33024-33-8 |
2 | 165.010 |
| 81-676-2 |
2,6-Methano-1,4(2h)-benzoxazocin-5(6h)-one,4(3h)-cyclohexyl-6-phenyl-
|
|
2 | 272.250 |
| 81-780-6 |
7H-Benzimidazo[2,1-a]benz[de]isoquinolin-7-one
|
23749-58-8 |
2 | 193.010 |
| 82-059-6 |
2-(N,n-di-n-pentyl amino)-3-(n-pentyl)pyrazine
|
|
2 | 284.750 |
| 82-334-0 |
2,2-Dimethyl-3-piperidino spiro[3.5]nonan-1-ol
|
|
2 | 219.570 |
| 83-134-1 |
As-triazino[5,6-b]indole, 3-(3'-hydroxypropylamino)-5-methyl-
|
4046-86-0 |
2 | 191.420 |
| 83-137-8 |
Triazolo[4,5-d]pyrimidine, 3h-v-,5-amino-7-benzylthio-3-ethyl-
|
96229-34-4 |
2 | 207.580 |
| 83-146-8 |
Benzoic acid, 3,5-bis[3-(2-chloroethyl)-3-nitrosoureido]-
|
13907-61-4 |
2 | 268.350 |
| 83-298-0 |
4,4,6-Trimethyl-2-phenylimino-4H-1,3-thiazine
|
27058-61-3 |
2 | 187.120 |
| 83-773-2 |
9H-adenine, n^6-(3,3-dimethyl-4-hydroxy-n-butyl)-
|
116295-96-6 |
2 | 182.700 |
| 84-577-9 |
N-acetyl-n-(p-phthalimidobenze-sulfonyl)-2-amino-4,6-dimethylpyrimidine
|
|
2 | 311.420 |
| 84-647-1 |
4H,6h-m-dioxino[4',5':5,6]pyrano[4,3-d]-4-oxazolin-2-one, hexahydro-4-methoxy-1,8-diphenyl-
|
|
2 | 267.550 |
| 84-672-3 |
9H-purine-6(1h)-thione, 9-benzyl-1-[2-(p-tolylthio)ethyl]-
|
|
2 | 292.930 |
| 84-991-9 |
1-(8-Bromo-dibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminopropane, TFA
|
|
2 | 214.230 |
| 85-062-9 |
Phenyl thiolcarbamic acid, 5-anilino-1,3,4-thia-diazol-2-yl ester
|
|
2 | 229.420 |
| 85-249-2 |
2,2-Dimethyl-1-(2'-methyl-delta^2-pentenyl)-3-piperazinone
|
|
2 | 186.310 |
| 85-437-3 |
4-P-bromoanilino-6-methyl-1,3,3a,7-tetrazaindene
|
|
2 | 184.660 |
| 85-525-5 |
1-(N,n-dimethylthiocarbamoylthio)-2-propanone 2,4-dinitrophenyl-hydrazone
|
96432-96-1 |
2 | 245.060 |
| 85-593-0 |
Formamide, n-(4-amino-2,6-dichloropyrimidin-5-yl)-n-benzyl-
|
91962-06-0 |
2 | 198.390 |
| 85-718-1 |
Semicarbazide, 4-cyclohexyl-1-(4-hydroxy-6-methyl-2-pyrimidinyl)-3-thio-, (keto form)
|
116435-06-4 |
2 | 213.140 |
| 86-081-7 |
1,4-Piperazinedicarboxamide, n,n'-bis-(2-chloroethyl)-n,n'-dinitroso-
|
|
2 | 231.540 |
| 86-088-0 |
Urea, 1-methyl-3-[2-[6-(methylthio)-9h-purin-9-yl]ethyl]-
|
90924-88-2 |
2 | 190.640 |
| 86-655-0 |
Carbamic acid, n-(4-phthalimidobutyl)-n- (p-tolylsulfonyl)-, ethyl ester
|
|
2 | 321.090 |
| 87-371-4 |
3,5,6,7-Tetramethoxy-2-(4-methoxyphenyl)-4h-chromen-4-one
|
|
2 | 266.770 |
| 87-985-3 |
3H-v-triazolo[4,5-d]pyrimidine, 5-amino-7-chloro-
|
|
2 | 100.420 |
| 88-655-8 |
3-(N-methylanilino)-2-(n-pentyl)-5-(n-heptyl) pyrazine
|
|
2 | 317.350 |
| 88-868-2 |
Phenanthro[3,2-b]furan-7,11-dione, 4,8-dimethyl-
|
|
2 | 199.950 |
| 89-083-2 |
2-(N,n-di-n-hexylamino)-3,6-dimethyl pyrazine
|
|
2 | 270.660 |
| 90-731-0 |
2-Norbornanol, 3-(piperidinomethyl)-, mixture of endo- and exo- isomers
|
116404-29-6 |
2 | 177.300 |
| 90-886-9 |
Oxadiazole, 1,2,4-, 3-(5-nitrofuran-2-yl)-5-(phenyloxymethyl)-
|
36883-92-8 |
2 | 186.340 |
| 91-347-6 |
Carbazic acid, 3-(5-amino-6-chloro-4-pyrimidinyl)-, benzyl ester
|
15180-19-5 |
2 | 202.000 |
| 91-695-0 |
2,6-Pyridinedicarbamic acid, 4-amino-3-nitro-, diethyl ester
|
16335-92-5 |
2 | 214.310 |
| 92-126-0 |
Phosphonic acid, chloro, cyclic 2-ethyl-2-hydroxy-methyltrimethylene ester
|
|
2 | 140.720 |
| 92-507-7 |
Urea, 1-(2-chloroethyl)-1-nitro-3-(3,5,7-trimethyl-1-adamantyl)-
|
33021-99-7 |
2 | 249.040 |
| 92-790-3 |
Benzo[1,2-b:5,4-b']difuran-4,8-dione, 2,3-dihydro-5-methyl-2-(1-methylethenyl)-, (-)-
|
|
2 | 173.220 |
| 92-966-8 |
Naphtho[2,3-b]furan-9(4H)-one, 4a,5,6,7,8,8a-hexahydro-3,4a,5-trimethyl-, [4aR-(4a«alpha»,5«alpha»,8a«alpha»)]-
|
|
2 | 188.470 |
| 93-557-1 |
Ribofuranose, 1-azido-1-deoxy-2,3-o-isopropylidene-, benzoate
|
88237-98-3 |
2 | 223.120 |
| 93-565-2 |
Thiopyran-3-carboxylic acid, 5-benzamido-4-oxo-, ethyl ester
|
116277-58-8 |
2 | 224.500 |
| 93-567-0 |
9H-purine-6(1h)-thione, 1-[3-(p-tolylthio)propyl]-
|
|
2 | 232.150 |
| 94-010-6 |
[1,2,5]-Thiadiazolo[3,4-d]pyrimidine, 5,7-dipyrrolidin-1-yl-
|
|
2 | 195.530 |
| 94-051-1 |
Benzoic acid, 4-[3-(2-chloroethyl)-3-nitrosoureido]-3,5-dimethyl-
|
|
2 | 208.940 |
| 94-054-8 |
Urea, 1,1'-p-phenylenebis[3-(2-fluoroethyl)-3-nitroso-
|
116277-65-7 |
2 | 225.880 |
| 94-127-7 |
4-M-chloroanilino-6-methyl-1,3,3a,7-tetrazaindene
|
|
2 | 179.400 |
| 94-140-2 |
Formamide, n-(4-amino-6-chloropyrimidin-5-yl)-n-benzyl-
|
|
2 | 186.150 |
| 94-167-3 |
Imidazol-5-yl,1-methyl-4-nitro-p-acetamidophenyl,sulfone
|
5702-78-3 |
2 | 213.740 |
| 94-522-8 |
2-(2,2-Dimethylpentoxy)-3-methyl-6-(5-nonyl) pyrazine
|
116660-07-2 |
2 | 308.820 |
| 95-199-7 |
3-(N-methylanilino)-2-(n-pentyl)-5-(5-nonyl) pyrazine
|
|
2 | 345.530 |
| 96-663-0 |
4-Methyl-5-trifluoromethyl-4H-1,2,4-tri- azolin-3(2H)-thione
|
30682-81-6 |
2 | 99.360 |
| 96-666-7 |
Imidazole-4(or 5)-carboxamide, 5(or 4)-diazo-4,5-dihydro-
|
121514-72-5 |
2 | 94.930 |
| 96-714-3 |
4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane-1-sulfide
|
3196-56-3 |
2 | 114.010 |
| 96-755-8 |
7H-imidazo[4,5-d]-v-triazin-4-one, 6-methyl-
|
94190-03-1 |
2 | 98.160 |
| 96-756-7 |
Pyrimido[5,4-e]-as-triazin-5[6h]-one, 1,2-dihydro-
|
|
2 | 98.160 |
| 96-761-1 |
[6H]thiazolo[5,4-d]pyrimidine-7-thione, 5-amino-
|
|
2 | 115.010 |
| 97-086-0 |
8-Azabicyclo[3.2.1]octan-3-ol, 8-methyl-, 8-oxide, (endo,anti)-
|
|
2 | 123.580 |
| 97-223-7 |
2-(P-nonylphenoxy)-3-(n-pentyl)-6-(5-nonyl) pyrazine
|
116402-98-3 |
2 | 454.140 |
| 97-257-0 |
2-(2,2-Dimethylpentoxy)-3-(n-pentyl)-6-(n-heptyl) pyrazine
|
3049-56-7 |
2 | 337.000 |
| 97-686-4 |
1-Aminocyclopentanecarboxylic acid, N-(but-2-yn-1-yloxycarbonyl)-, octyl ester
|
|
2 | 283.970 |
| 97-833-0 |
3-Benzofuran carboxamide, n-(n-butyl)-2,3-dihydro-3-phenyl-
|
94310-89-1 |
2 | 237.610 |
| 98-172-3 |
10-Methoxy-14-methyl-5-oxo-5,7,8,14-tetrahydro-indolo-[2,3-c]-quinazo-[3,2,a]-pyridine
|
|
2 | 241.340 |
| 98-388-4 |
3H-1,2,4-Triazole-3-thione,2,4-dihydro-2,4,5-trimethyl-
|
37526-42-4 |
2 | 108.140 |
|
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