| ID LINK | NAME | STRUCTURE CAS | CLOGP | CLOGS | MW | FREQ | DURGS WITH THIS FRAGMENT |
|---|---|---|---|---|---|---|---|
| FDBF00042 | propan-2-ol |
|
-0.132 | 0.047 | 60.095 | 0.0278 |
Octreotide ,Pravastatin ,Esmolol ,Betaxolol ,Fluconazole ,Nelfinavir ,Indinavir ,Ranolazine ,Metoprolol ,Tenofovir , ( Total
57 Medicines )
propoxur ,pyriproxyfen ,ecdysterone ,IPSP ,tebupirimfos ,prothidathion ,propisochlor ,phenisopham ,profoxydim ,bensulide , ( Total 24 Pesticides) |
| FDBF00025 | propan-1-amine |
|
-0.200 | -0.540 | 59.110 | 0.0292 |
Felypressin ,Octreotide ,L-Lysine ,Spermine ,L-Ornithine ,Ramipril ,Indecainide ,Isoetarine ,Pregabalin ,Lymecycline , ( Total
66 Medicines )
oryzalin ,dipropalin ,fluchloralin ,isopropalin ,methalpropalin ,nitralin ,pendimethalin ,prodiamine ,profluralin ,trifluralin , ( Total 19 Pesticides) |
| FDBF04916 | sulfanylphosphinous acid |
|
-1.723 | 0.589 | 82.062 | 0.0292 | acethion ,chlorethoxyfos ,chlormephos ,demephion ,demephion-O ,demeton ,demeton-O ,demeton-methyl ,disulfoton ,ethion , ( Total 85 Pesticides) |
| FDBF00022 | prop-1-ene |
|
0.442 | -0.470 | 42.080 | 0.0299 |
Cyclosporine ,Alpha-Linolenic Acid ,Dihomo-gamma-linolenic acid ,Icosapent ,Butalbital ,Cabergoline ,Travoprost ,Talbutal ,Pimecrolimus ,Secobarbital , ( Total
49 Medicines )
allicin ,d-limonene ,cinerins ,cinerin I ,cinerin II ,jasmolin I ,jasmolin II ,rotenone ,allyxycarb ,copper oleate , ( Total 38 Pesticides) |
| FDBF00289 | N,N-dimethylethanamine |
|
-0.179 | -0.646 | 73.137 | 0.0299 |
Dofetilide ,Citalopram ,Oxyphenonium ,Cefotiam ,Cabergoline ,Ropinirole ,Venlafaxine ,Ibutilide ,Zolmitriptan ,Amitriptyline , ( Total
81 Medicines )
bensultap ,cartap ,thiosultap ,propamocarb ,prothiocarb ,spiroxamine , ( Total 6 Pesticides) |
| FDBF00081 | pentane |
|
1.336 | -1.729 | 72.149 | 0.0316 |
Alpha-Linolenic Acid ,Dihomo-gamma-linolenic acid ,Vitamin E ,Cholecalciferol ,Oseltamivir ,Ibutilide ,Pentobarbital ,Anidulafungin ,Meprobamate ,Treprostinil , ( Total
63 Medicines )
bufencarb ,dinosam ,copper oleate ,epofenonane ,hydroprene ,kinoprene ,methoprene ,triprene ,pendimethalin ,dinosam , ( Total 29 Pesticides) |
| FDBF00105 | methyl formate |
|
-0.181 | 0.218 | 60.052 | 0.0323 |
Phosphatidylserine ,Aspartame ,Esmolol ,Succinylcholine ,Reserpine ,Oxyphenonium ,Vindesine ,Vinorelbine ,Oxyphencyclimine ,Valrubicin , ( Total
73 Medicines )
indoxacarb ,bifenthrin ,kappa-bifenthrin ,chlorempenthrin ,empenthrin ,furamethrin ,imiprothrin ,japothrins ,proparthrin ,tefluthrin , ( Total 21 Pesticides) |
| 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) |
| 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) |
| FDBF00064 | N,N-dimethylmethanamine |
|
-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) |
5919 ,
592
