aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21271 | 1.06 | 234.24 | C13H8N5 | Nc1ncnc2c1C(C#Cc1ccccc1)=N[N]2 |
|
AD21272 | 2.88 | 272.71 | C15H11ON3Cl | ClC1=C[N]c2ncnc(OCCc3ccccc3)c21 |
|
AD21273 | 0.96 | 260.25 | C12H12O3N4 | NCCOc1cccc2c1Nc1nc(=O)[nH]cc1O2 |
|
AD21274 | 4.5 | 435.52 | C26H29O5N | CC(C)(C)c1ccc(Oc2ccc(NC(=O)C3=COC(O)C4C(CO)=CCC34)cc2)cc1 |
|
AD21275 | 1.83 | 284.81 | C14H17ON2ClS | CSCCNC(=O)C1Cc2ccc(Cl)cc2CN1 |
|
AD21276 | 3.33 | 518.69 | C30H46O7 | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CC(=O)C4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1O |
|
AD21277 | 9.44 | 566.27 | C37H52O2NCl | CC1(C)CCC2(C(=O)Nc3ccccc3Cl)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD21278 | 7.89 | 574.89 | C36H62O5 | CCCCCCCCCCCCCC(=O)OCC(C)C1(O)C(O)CC2C3CC=C4CC(O)CCC4(C)C3CCC21C |
|
AD21279 | 2.87 | 780.06 | C42H73O10N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCC(=O)NCCCCc2ccccc2)C(C)C(O)C1(C)O |
|
AD21280 | -0.88 | 350.37 | C17H22O6N2 | Cc1ccc(CCNC(=O)C2=CC(O)C(O)C(OCC(N)=O)O2)cc1 |