aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17161 | 2.82 | 191.25 | C10H9ONS | COc1ccc(-c2cscn2)cc1 |
|
AD17162 | 8.88 | 526.85 | C35H58O3 | CCCCCOC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(C)C4CCC3(C)C1(C)CC2 |
|
AD17163 | 4.14 | 271.4 | C18H25ON | CNCCCCCCOCc1ccc2ccccc2c1 |
|
AD17164 | 3.16 | 364.28 | C16H11O3N4F3 | O=C(O)NNC(=O)c1ccc2[nH]c(-c3ccc(C(F)(F)F)cc3)nc2c1 |
|
AD17165 | 0.18 | 192.22 | C10H12O2N2 | O=CNCc1ccc(CNC=O)cc1 |
|
AD17166 | 0.08 | 265.25 | C9H7O3N5S | NC(=S)NN=C1C(=O)Nc2ccc([N+](=O)[O-])cc21 |
|
AD17167 | 1.43 | 617.82 | C32H59O10N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC3CC3)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O |
|
AD17168 | 2.57 | 302.42 | C18H26O2N2 | CCC(=O)NC(Cc1ccccc1)C(=O)NC1CCCCC1 |
|
AD17169 | 6.55 | 484.81 | C29H60O3N2 | CC(N)C(O)CCCCCCCCCCCCCCC(=O)CCCCCCCCC(O)C(C)N |
|
AD17170 | 2.44 | 794.98 | C40H66O12N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OCC=CNCCc2ccc([N+](=O)[O-])cc2)CC(C)NC(=O)C(C)C(O)C1(C)O |