| ID LINK | NAME | STRUCTURE CAS | CLOGP | CLOGS | MW | FREQ | DURGS WITH THIS FRAGMENT |
|---|---|---|---|---|---|---|---|
| FDBF00205 | 1-chloro-4-methyl-benzene |
|
2.993 | -2.753 | 126.583 | 0.0113 |
Baclofen ,Cetirizine ,Buclizine ,Hydroxyzine ,Butoconazole ,Mitotane ,Meclizine ,Carbinoxamine ,Azelastine ,Chlorphenamine , ( Total
18 Medicines )
DDT ,TDE ,protrifenbute ,closantel ,thiobencarb ,chlorfenprop ,mandipropamid ,valifenalate ,oxpoconazole ,fenbuconazole , ( Total 15 Pesticides) |
| FDBF00302 | 1-chloro-2-methyl-benzene |
|
2.993 | -2.753 | 126.583 | 0.0062 |
Ticlopidine ,Clotrimazole ,Mitotane ,Clopidogrel ,Ambenonium ,Dapagliflozin ,Fominoben ,Empagliflozin ,Tolfenamic Acid ,Clonixin , ( Total
10 Medicines )
flupoxam ,pentanochlor ,tefuryltrione ,tembotrione ,orbencarb ,cumyluron ,clomazone ,clotrimazole , ( Total 8 Pesticides) |
| FDBF02854 | 1-chloro-3-methyl-benzene |
|
2.993 | -2.753 | 126.583 | 0.0031 |
Dasatinib ,Avanafil , ( Total
2 Medicines )
chlordimeform ,fenasulam ,MCPA ,MCPA-thioethyl ,MCPB ,mecoprop ,mecoprop-P , ( Total 7 Pesticides) |
| FDBF04820 | 2-cyclopentyl-3-methylcyclopenta-2,4-dien-1-one |
|
2.992 | -2.193 | 162.228 | 0.0003 | cyclethrin , ( Total 1 Pesticides) |
| FDBF07256 | 2-methyl-4-propan-2-yloxybenzaldehyde |
|
2.992 | -2.840 | 178.228 | 0.0003 | isofetamid , ( Total 1 Pesticides) |
| FDBF03479 | 4-tert-butyl-2-methyl-phenol |
|
2.991 | -2.956 | 164.244 | 0.0003 |
Tyloxapol , ( Total
1 Medicines )
|
| FDBF00110 | 4,5-dimethylthiazole |
|
2.990 | -1.858 | 113.181 | 0.0003 |
Thiamine , ( Total
1 Medicines )
|
| FDBF01311 | 2,4-dimethylthiazole |
|
2.990 | -1.858 | 113.181 | 0.0003 |
Nizatidine , ( Total
1 Medicines )
|
| FDBF01941 | allylbenzene |
|
2.990 | -2.439 | 118.176 | 0.0003 |
Alprenolol , ( Total
1 Medicines )
|
| FDBF05796 | 2,6-dibromo-4-methanimidoylphenol |
|
2.989 | -3.315 | 278.929 | 0.0003 | bromofenoxim , ( Total 1 Pesticides) |
5919 ,
592
