| ID LINK | NAME | STRUCTURE CAS | CLOGP | CLOGS | MW | FREQ | DURGS WITH THIS FRAGMENT |
|---|---|---|---|---|---|---|---|
| FDBF00026 | propanamide |
|
-0.459 | -0.125 | 73.094 | 0.0148 |
Felypressin ,L-Glutamine ,Glutathione ,Valsartan ,Bortezomib ,Remikiren ,Indinavir ,Disopyramide ,Sufentanil ,Prilocaine , ( Total
35 Medicines )
napropamide ,napropamide-M ,tiafenacil ,clomeprop ,erlujixiancaoan ,naproanilide ,pentanochlor ,propanil , ( Total 8 Pesticides) |
| FDBF00069 | N-methylpropan-1-amine |
|
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) |
| FDBF00086 | hexane |
|
1.780 | -2.167 | 86.175 | 0.0151 |
Alpha-Linolenic Acid ,Ibutilide ,Mupirocin ,Sodium Tetradecyl Sulfate ,Nabilone ,Sodium lauryl sulfate ,Misoprostol ,Salmeterol ,Hexafluronium ,Demecarium , ( Total
27 Medicines )
copper oleate ,EBEP ,pyridate ,pelargonic acid ,dodicin ,dodine ,meptyldinocap ,dinosulfon ,glyodin ,aldimorph , ( Total 17 Pesticides) |
| FDBF00101 | methyl acetate |
|
-0.072 | -0.209 | 74.079 | 0.0151 |
Phosphatidylserine ,Aspartame ,Esmolol ,Succinylcholine ,Amcinonide ,Valrubicin ,Methylphenidate ,Famciclovir ,Cefalotin ,Verteporfin , ( Total
36 Medicines )
butonate ,valerate ,plifenate ,tiafenacil ,flucetosulfuron ,pefurazoate ,valifenalate ,fenitropan , ( Total 8 Pesticides) |
| FDBF00370 | difluoromethane |
|
1.258 | -0.641 | 52.023 | 0.0151 |
Pantoprazole ,Enflurane ,Perflutren ,Isoflurane ,Fulvestrant ,Methoxyflurane ,Lubiprostone ,Desflurane ,Roflumilast ,Eflornithine , ( Total
11 Medicines )
flursulamid ,sulfluramid ,hexaflumuron ,lufenuron ,novaluron ,noviflumuron ,pyriprole ,brofluthrinate ,flucythrinate ,flupyradifurone , ( Total 33 Pesticides) |
| FDBF01768 | methoxyphosphinothious acid |
|
0.483 | -0.142 | 96.089 | 0.0155 |
Malathion , ( Total
1 Medicines )
fosmethilan ,phenthoate ,demephion ,demephion-O ,demeton ,demeton-O ,demeton-methyl ,isothioate ,malathion ,thiometon , ( Total 44 Pesticides) |
| FDBF00212 | N-methylpropan-2-amine |
|
0.095 | -1.005 | 73.137 | 0.0158 |
Esmolol ,Indecainide ,Betaxolol ,Isoetarine ,Metoprolol ,Disopyramide ,Atenolol ,Sotalol ,Propranolol ,Labetalol , ( Total
44 Medicines )
benfuracarb ,saflufenacil , ( Total 2 Pesticides) |
| FDBF00569 | acetonitrile |
|
-0.188 | -0.105 | 41.052 | 0.0161 |
Cefmetazole ,Verapamil ,Diphenoxylate ,Cefacetrile ,Difenoxin ,Fenproporex ,Cinolazepam ,Estradiol valerate/Dienogest ,Ruxolitinib ,Tofacitinib , ( Total
12 Medicines )
nitrilacarb ,thiocarboxime ,acrinathrin ,brofenvalerate ,brofluthrinate ,cycloprothrin ,cyfluthrin ,cyhalothrin ,gamma-cyhalothrin ,lambda-cyhalothrin , ( Total 35 Pesticides) |
| FDBF00790 | pyrimidine |
|
1.189 | -0.927 | 80.088 | 0.0161 |
Sulfadiazine ,Buspirone ,Bosentan ,Imatinib ,Rosuvastatin ,Sulfadoxine ,Glycodiazine ,Nilotinib ,Silver sulfadiazine ,Sulfadimethoxine , ( Total
16 Medicines )
butathiofos ,etrimfos ,lirimfos ,tebupirimfos ,triflumezopyrim ,pyrimisulfan ,bispyribac ,pyriminobac ,pyrithiobac ,azimsulfuron , ( Total 31 Pesticides) |
| FDBF00099 | ethanethiol |
|
0.445 | -0.614 | 62.134 | 0.0165 |
Glutathione ,Nelfinavir ,Montelukast ,Cimetidine ,Nizatidine ,Butoconazole ,Malathion ,Ranitidine ,Famotidine ,Echothiophate , ( Total
17 Medicines )
EMPC ,ethiofencarb ,bensultap ,thiosultap ,amiton ,cadusafos ,demephion-S ,demeton ,demeton-O ,demeton-S , ( Total 31 Pesticides) |
5919 ,
592
