| ID LINK | NAME | STRUCTURE CAS | CLOGP | CLOGS | MW | FREQ | DURGS WITH THIS FRAGMENT |
|---|---|---|---|---|---|---|---|
| FDBF00019 | (E)-hex-2-ene |
|
1.600 | -1.443 | 84.159 | 0.0014 |
Cyclosporine ,Oleic Acid ,Ethanolamine Oleate ,Idebenone , ( Total
4 Medicines )
|
| FDBF00018 | propan-1-ol |
|
0.038 | -0.327 | 60.095 | 0.0330 |
Cyclosporine ,Pravastatin ,Ethchlorvynol ,Oseltamivir ,Remikiren ,Nelfinavir ,Indinavir ,Atomoxetine ,Penciclovir ,Ibutilide , ( Total
78 Medicines )
epofenonane ,pyriproxyfen ,α-ecdysone ,paichongding ,pyridalyl ,pretilachlor ,piperophos ,triaziflam ,propoxycarbazone ,aureofungin , ( Total 18 Pesticides) |
| FDBF00017 | (E)-but-2-ene |
|
0.714 | -0.556 | 56.106 | 0.0024 |
Cyclosporine ,Cerulenin ,Dinoprost Tromethamine ,Oleic Acid ,Ethanolamine Oleate ,Idebenone , ( Total
6 Medicines )
juvenile hormone I , ( Total 1 Pesticides) |
| FDBF00016 | chlorobenzene |
|
2.618 | -2.197 | 112.557 | 0.0718 |
Cetrorelix ,Baclofen ,Lorazepam ,Pyrimethamine ,Ticlopidine ,Clotrimazole ,Clemastine ,Chlorthalidone ,Indomethacin ,Cetirizine , ( Total
80 Medicines )
CPMC ,bistrifluron ,chlorbenzuron ,dichlorbenzuron ,diflubenzuron ,flucycloxuron ,flufenoxuron ,novaluron ,triflumuron ,halofenozide , ( Total 129 Pesticides) |
| FDBF00015 | acetamide |
|
-0.723 | 0.321 | 59.067 | 0.0460 |
Cetrorelix ,Felypressin ,L-Glutamine ,N-Acetyl-D-glucosamine ,Glutathione ,L-Asparagine ,Valsartan ,Bortezomib ,Oseltamivir ,Remikiren , ( Total
112 Medicines )
fosmethilan ,cyanthoate ,prothoate ,primidophos ,acephate ,phosglycin ,afoxolaner ,allosamidin ,fluralaner ,beflubutamid , ( Total 22 Pesticides) |
| FDBF00014 | pyridine |
|
1.626 | -1.146 | 79.100 | 0.0333 |
Cetrorelix ,Nicotine ,Pantoprazole ,Torasemide ,Indinavir ,Milrinone ,Disopyramide ,Doxylamine ,Sorafenib ,Dexbrompheniramine , ( Total
68 Medicines )
anabasine ,nicotine ,nornicotine ,pyriproxyfen ,pyriprole ,fenpirithrin ,sulfoxaflor ,afidopyropen ,pyridalyl ,pyrifluquinazon , ( Total 29 Pesticides) |
| FDBF00013 | pyrrol-2-one |
|
1.373 | -0.107 | 81.073 | 0.0021 |
Goserelin ,Ceruletide ,Gonadorelin ,Nafarelin ,Histrelin ,Triptorelin , ( Total
6 Medicines )
|
| FDBF00012 | isobutane |
|
0.723 | -0.909 | 58.122 | 0.0611 |
Goserelin ,Cyclosporine ,L-Leucine ,Vitamin E ,Cholecalciferol ,Bortezomib ,Remikiren ,Nelfinavir ,Indinavir ,Pregabalin , ( Total
99 Medicines )
nitrilacarb ,butacarb ,flubendiamide ,buprofezin ,hydroprene ,kinoprene ,methoprene ,triprene ,chromafenozide ,furan tebufenozide , ( Total 79 Pesticides) |
| FDBF00011 | imidazole |
|
1.364 | -0.630 | 68.077 | 0.0175 |
Goserelin ,L-Histidine ,Remikiren ,Oxiconazole ,Clotrimazole ,Bleomycin ,Etomidate ,Zoledronate ,Brimonidine ,Clonidine , ( Total
49 Medicines )
imidaclothiz ,glyodin , ( Total 2 Pesticides) |
| FDBF00010 | indole |
|
2.663 | -2.322 | 117.148 | 0.0086 |
Goserelin ,Octreotide ,L-Tryptophan ,Pentagastrin ,Eletriptan ,Zolmitriptan ,Ceruletide ,Gonadorelin ,Nafarelin ,Sumatriptan , ( Total
25 Medicines )
|
5919 ,
592
