ID LINK | NAME | STRUCTURE CAS | CLOGP | CLOGS | MW | FREQ | DURGS WITH THIS FRAGMENT |
---|---|---|---|---|---|---|---|
FDBF00069 | N-methylpropan-1-amine |
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0.266 | -1.379 | 73.137 | 0.0148 |
Spermine ,Lymecycline ,Ropinirole ,Atomoxetine ,Ibutilide ,Ethambutol ,Protriptyline ,Alfuzosin ,Fluoxetine ,Duloxetine , ( Total
31 Medicines )
oryzalin ,dipropalin ,fluchloralin ,isopropalin ,methalpropalin ,nitralin ,prodiamine ,profluralin ,trifluralin ,prosulfalin , ( Total 12 Pesticides) |
FDBF00068 | N-methylethanamine |
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-0.133 | -0.933 | 59.110 | 0.0429 |
Spermine ,Ramipril ,Dofetilide ,Oxyphenonium ,Gadodiamide ,Lymecycline ,Ropinirole ,Lidocaine ,Atomoxetine ,Ibutilide , ( Total
115 Medicines )
alanycarb ,nitenpyram ,amiton ,phosglycin ,cambendichlor ,benfluralin ,ethalfluralin ,dodicin ,blasticidin-S ,spiroxamine , ( Total 10 Pesticides) |
FDBF00067 | butane |
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0.893 | -1.283 | 58.122 | 0.0680 |
Spermine ,Alpha-Linolenic Acid ,Calcitriol ,Calcidiol ,Dihomo-gamma-linolenic acid ,Vitamin E ,L-Isoleucine ,Cholecalciferol ,Pravastatin ,Fluvoxamine , ( Total
135 Medicines )
furathiocarb ,fenobucarb ,flursulamid ,copper oleate ,epofenonane ,hydroprene ,kinoprene ,methoprene ,triprene ,abamectin , ( Total 63 Pesticides) |
FDBF00066 | N-methylmethanamine |
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-0.486 | -0.476 | 45.084 | 0.0914 |
Spermine ,Tramadol ,Erythromycin ,Dofetilide ,Azithromycin ,Citalopram ,Oxyphenonium ,Gadodiamide ,Cefotiam ,Cabergoline , ( Total
204 Medicines )
pirimicarb ,alanycarb ,allyxycarb ,aminocarb ,mexacarbate ,chlordimeform ,formetanate ,formparanate ,medimeform ,spinetoram , ( Total 62 Pesticides) |
FDBF00065 | ethylene glycol |
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-0.637 | 0.629 | 62.068 | 0.0265 |
Vitamin C ,Riboflavin ,N-Acetyl-D-glucosamine ,Esmolol ,Betaxolol ,Remikiren ,Ranolazine ,Metoprolol ,Travoprost ,Calcium Gluceptate , ( Total
68 Medicines )
2,4-DEP ,disul ,fenteracol ,polyoxorim ,debacarb ,triadimenol ,ethylmercury 2,3-dihydroxypropyl mercaptide ,bitertanol ,polyoxorim-zinc , ( Total 9 Pesticides) |
FDBF00064 | N,N-dimethylmethanamine |
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-0.577 | -0.200 | 59.110 | 0.0371 |
Choline ,Tramadol ,Succinylcholine ,Dofetilide ,Citalopram ,Cefotiam ,Cabergoline ,Ropinirole ,Venlafaxine ,Zolmitriptan , ( Total
103 Medicines )
bensultap ,cartap ,thiosultap ,propamocarb ,prothiocarb , ( Total 5 Pesticides) |
FDBF00063 | (trimethyl-λ4-azanyl)methane |
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-2.931 | -1.350 | 74.145 | 0.0048 |
Choline ,Succinylcholine ,Carbachol ,L-Carnitine ,Bethanechol ,Echothiophate ,Decamethonium ,Oxtriphylline ,Trisalicylate-choline ,Acetylcholine , ( Total
14 Medicines )
|
FDBF00062 | pentanoic acid |
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0.522 | -0.780 | 102.132 | 0.0079 |
Biotin ,Alpha-Linolenic Acid ,Dihomo-gamma-linolenic acid ,Lipoic Acid ,Valproic Acid ,Mupirocin ,Aminocaproic Acid ,Anisotropine Methylbromide ,Azelaic Acid ,Alprostadil , ( Total
20 Medicines )
copper oleate ,pelargonic acid ,pentachlorophenyl laurate , ( Total 3 Pesticides) |
FDBF00061 | butyric acid |
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0.133 | -0.349 | 88.105 | 0.0131 |
Biotin ,Alpha-Linolenic Acid ,Dihomo-gamma-linolenic acid ,Icosapent ,Lipoic Acid ,Pregabalin ,Chlorambucil ,Mupirocin ,Carboprost Tromethamine ,Aminocaproic Acid , ( Total
29 Medicines )
copper oleate ,butonate ,4-CPB ,2,4-DB ,3,4-DB ,MCPB ,2,4,5-TB ,pelargonic acid ,pentachlorophenyl laurate , ( Total 9 Pesticides) |
FDBF00060 | 2-oxopropanoic acid |
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-0.479 | 0.512 | 88.062 | 0.0003 |
Pyruvic acid , ( Total
1 Medicines )
|
5919 ,
592