| ID LINK | NAME | STRUCTURE CAS | CLOGP | CLOGS | MW | FREQ | DURGS WITH THIS FRAGMENT |
|---|---|---|---|---|---|---|---|
| FDBF02355 | (11bR)-4-oxo-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-carbaldehyde |
|
1.104 | -1.739 | 230.262 | 0.0003 |
Praziquantel , ( Total
1 Medicines )
|
| FDBF03198 | (11bS)-1,3,4,6,7,11b-hexahydropyrido[2,1-a]isoquinolin-2-one |
|
2.488 | -2.730 | 201.264 | 0.0003 |
Tetrabenazine , ( Total
1 Medicines )
|
| FDBF03193 | (11bS)-10-methoxy-1,3,4,6,7,11b-hexahydropyrido[2,1-a]isoquinolin-2-one |
|
2.461 | -3.012 | 231.290 | 0.0003 |
Tetrabenazine , ( Total
1 Medicines )
|
| FDBF03194 | (11bS)-9-methoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one |
|
2.461 | -3.012 | 231.290 | 0.0003 |
Tetrabenazine , ( Total
1 Medicines )
|
| FDBF06730 | (1E)-1-methoxy-3-(methyl-λ3-oxidanylidene)prop-1-en-1-ol |
|
0.157 | -0.120 | 116.115 | 0.0024 | azoxystrobin ,coumoxystrobin ,enoxastrobin ,flufenoxystrobin ,jiaxiangjunzhi ,picoxystrobin ,pyraoxystrobin , ( Total 7 Pesticides) |
| FDBF07635 | (1E)-N-(piperazin-1-ylmethyl)methanimidic acid |
|
0.191 | -0.276 | 143.187 | 0.0003 | triforine , ( Total 1 Pesticides) |
| FDBF06484 | (1E)-N-methylmethanimidothioic acid |
|
0.737 | -0.339 | 75.133 | 0.0024 | metam ,cuprobam ,amobam ,ferbam ,metam ,nabam ,ziram , ( Total 7 Pesticides) |
| FDBF07637 | (1E)-N-[(1R)-2,2,2-trichloro-1-piperazin-1-ylethyl]methanimidic acid |
|
1.605 | -1.844 | 260.549 | 0.0003 | triforine , ( Total 1 Pesticides) |
| FDBF06199 | (1E)-N-[4-(dimethylcarbamoyl)phenyl]methanimidic acid |
|
1.162 | -1.373 | 192.214 | 0.0003 | foramsulfuron , ( Total 1 Pesticides) |
| FDBF04740 | (1R)-1,2,2,2-tetrachloroethanol |
|
2.379 | -1.867 | 183.849 | 0.0003 | chlorethoxyfos , ( Total 1 Pesticides) |
5919 ,
592
