aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10041 | 1.45 | 361.44 | C19H27O4N3 | CCCCOc1ccc(NC(=O)C2=CCN(C)C(CO)C(=O)N2C)cc1 |
|
AD10042 | 8.33 | 575.88 | C38H57O3N | COc1ccc(CNC(=O)C23CCC(C)C(C)C2C2=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C2(C)CC3)cc1 |
|
AD10043 | 20.71 | 887.6 | C60H118O3 | CCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)OC)C(O)CCCCCCCCCCCC1CC1CCCCCCCCCCCCCCCCCC |
|
AD10044 | 20.71 | 887.6 | C60H118O3 | CCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCC1CC1CCCCCCCCCCCCCCCCCC)C(=O)OC |
|
AD10045 | 2.27 | 128.12 | C7H6F2 | Cc1cccc(F)c1F |
|
AD10046 | 2.68 | 241.3 | C12H9N4S | C1=Nc2c(ncnc2SCc2ccccc2)[N]1 |
|
AD10047 | 2.82 | 545.58 | C28H28O4N7F | O=CNc1ccc(-c2cn(CCN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C4CC4)CC3)nn2)cc1 |
|
AD10048 | 6.83 | 835.52 | C46H71O10N2Cl | CCC(C)N(CC1CC1)C1CC(C)OC(OC2C(C)C(O)C(C)C(=O)OC(CC)C3(C)OC(=O)N(CCc4ccc(Cl)cc4)C3C(C)C(=O)C(C)CC2(C)OC)C1O |
|
AD10049 | 1.88 | 863.1 | C46H74O13N2 | CC1C=CC=CC=CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)C(O)CCC(O)CC(O)CC(O)CC(=O)OC(C)C(C)C1O)CC(O)C2C(=O)NCCCN(C)C |
|
AD10050 | 3.97 | 437.92 | C22H22ON8Cl | COc1ccc(Cl)c(CNc2nc(-n3cc(CC4CCCC4)nn3)nc3c2N=C[N]3)c1 |