aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00231 | 3.8 | 309.39 | C17H15ON3S | COc1ccccc1Cc1nc(-c2ccccc2)n[nH]c1=S |
|
AD00232 | 6.59 | 680.85 | C33H40O6N6S2 | O=C(CCCCCN=C(S)Nc1ccc(O)cc1)Nc1cc(NC(=O)CCCCCN=C(S)Nc2ccc(O)cc2)cc(C(=O)O)c1 |
|
AD00233 | 2.02 | 149.24 | C10H15N | CNCc1ccc(C)cc1C |
|
AD00234 | -4.44 | 433.51 | C18H35O7N5 | NCCC(O)C(=O)NC1CC(N)C(OC2OC(CNCCO)=CCC2N)C(O)C1O |
|
AD00235 | 1.45 | 183.58 | C7H4ON4Cl | ONc1cc(Cl)nc2c1N=C[N]2 |
|
AD00236 | 6.28 | 458.73 | C30H50O3 | CC(C)=CCC=C(C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C |
|
AD00237 | 0.6 | 308.29 | C13H10ON9 | OCc1cnn(-c2nc3c(c(Nc4cnccn4)n2)N=C[N]3)c1 |
|
AD00238 | 4.3 | 434.66 | C27H46O4 | CC(C)CCC(O)C(C)C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3C(O)CC21C |
|
AD00239 | 3.08 | 665.87 | C36H59O10N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OCc2ccccc2)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD00240 | 1.46 | 384.48 | C22H28O4N2 | CC(=O)NC1CCC2(O)C3Cc4ccc(O)c5c4C2(CCN3CC2CC2)C1O5 |