aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16791 | 4.35 | 546.75 | C32H50O7 | CC(=O)OC1C2C3(C)CCC(C(C)(C)O)(OCC24CCC25CC26CCC(O)C(C)(C)C6CCC5C4(C)C1O)O3 |
|
AD16792 | 2.33 | 1413.3 | C70H71O17N13Cl2 | NCCNCCNCCNCCNCCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD16793 | -4.16 | 418.29 | C12H23O12N2P | COP(=O)(O)OC1(C(=O)O)CC(O)C(NC(=O)CN)C(C(O)C(O)CO)O1 |
|
AD16794 | 1.01 | 256.29 | C13H14ON5 | Nc1nc(C#CC2(O)CCCCC2)nc2c1N=C[N]2 |
|
AD16795 | -1.36 | 139.14 | C5H7ON4 | NC(=O)CC1=C(N)N=C[N]1 |
|
AD16796 | -0.47 | 316.35 | C15H24O7 | CC(C)CC(=O)OC1OC=C(CO)C2CC(O)C(O)(CO)C12 |
|
AD16797 | 3.14 | 221.26 | C14H11N3 | c1ccc(-c2ccc(-c3nc[nH]n3)cc2)cc1 |
|
AD16798 | 2.02 | 675.83 | C35H49O5N9 | CN(C)CCCc1cc2c3c(c(NCCCn4cc(CO)nn4)cc4c3c1C(=O)N(CCCN(C)C)C4=O)C(=O)N(CCCN(C)C)C2=O |
|
AD16799 | 2.18 | 237.29 | C14H13N4 | CN(C)c1ncnc2c1C(c1ccccc1)=C[N]2 |
|
AD16800 | 2.57 | 283.34 | C14H11ON4S | Oc1cccc(C=CCSc2ncnc3c2C=N[N]3)c1 |