| ID LINK | NAME | STRUCTURE CAS | CLOGP | CLOGS | MW | FREQ | DURGS WITH THIS FRAGMENT |
|---|---|---|---|---|---|---|---|
| FDBF01937 | (1R,2R,4R)-2-methoxy-4-[(Z)-prop-1-enyl]cyclohexanol |
|
1.580 | -0.880 | 170.249 | 0.0003 |
Tacrolimus , ( Total
1 Medicines )
|
| FDBF01975 | (1R,2R,4R)-2-methoxy-4-propyl-cyclohexanol |
|
1.759 | -1.600 | 172.265 | 0.0003 |
Sirolimus , ( Total
1 Medicines )
|
| FDBF01974 | (1R,2R,4R)-2-methoxy-4-methyl-cyclohexanol |
|
1.073 | -0.772 | 144.211 | 0.0003 |
Sirolimus , ( Total
1 Medicines )
|
| FDBF00820 | (1R,2R,3aS,9aS)-1-methyl-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[g]naphthalene-2,5-diol |
|
2.306 | -2.205 | 218.292 | 0.0003 |
Treprostinil , ( Total
1 Medicines )
|
| FDBF00819 | (1R,2R,3aS,9aS)-1-methyl-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[b]naphthalen-2-ol |
|
2.821 | -2.626 | 202.292 | 0.0003 |
Treprostinil , ( Total
1 Medicines )
|
| FDBF00822 | (1R,2R,3aS,9aS)-1-ethyl-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[g]naphthalene-2,5-diol |
|
2.661 | -2.609 | 232.318 | 0.0003 |
Treprostinil , ( Total
1 Medicines )
|
| FDBF00821 | (1R,2R,3aS,9aS)-1-(3-hydroxypropyl)-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[b]naphthalen-2-ol |
|
2.894 | -2.879 | 246.345 | 0.0003 |
Treprostinil , ( Total
1 Medicines )
|
| FDBF02460 | (1R,2R,3aS,6aS)-5-methylene-1-vinyl-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-ol |
|
2.302 | -1.424 | 164.244 | 0.0003 |
Iloprost , ( Total
1 Medicines )
|
| FDBF02471 | (1R,2R,3aS,6aS)-1-[(E,3S)-3-hydroxypent-1-enyl]-5-methylene-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-ol |
|
2.437 | -1.350 | 222.323 | 0.0003 |
Iloprost , ( Total
1 Medicines )
|
| FDBF02474 | (1R,2R,3aS,6aS)-1-[(E,3S)-3-hydroxy-4-methyl-pent-1-enyl]-5-methylene-2,3,3a,4,6,6a-hexahydro-1H-pentalen-2-ol |
|
2.653 | -1.381 | 236.350 | 0.0003 |
Iloprost , ( Total
1 Medicines )
|
5919 ,
592
