aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11271 | 2.98 | 357.34 | C16H24O6NP | CCC(C)OC(=O)C1CCCN1P(=O)(O)Oc1ccc(OC)cc1 |
|
AD11272 | 2.58 | 571.72 | C31H45O7N3 | COC1C(O)CC(=O)OC(CC=Cc2cnc(N)c3ccccc23)CCCN(C)CC(O)C(C)CC(CC=O)C1O |
|
AD11273 | 4.16 | 294.8 | C16H15O2ClS | Clc1sccc1Cc1ccc(OC2CCOC2)cc1 |
|
AD11274 | -2.58 | 390.36 | C15H18O5N8 | Cn1cc(COC(=O)CNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)nn1 |
|
AD11275 | 2.23 | 209.99 | C8H2O2NFCl2 | O=C(O)c1cc(F)c(Cl)nc1Cl |
|
AD11276 | 2.39 | 295.28 | C14H11O2N6 | O=[N+]([O-])c1ccc2c(c1)CCC2Nc1ncnc2c1N=C[N]2 |
|
AD11277 | 1.84 | 159.19 | C10H9ON | Cc1ccc2c(=O)[nH]ccc2c1 |
|
AD11278 | 0.35 | 261.28 | C13H15O3N3 | CN(C=O)CCC(=O)Nc1cccc2c1CNC2=O |
|
AD11279 | 1.31 | 233.25 | C10H13ON6 | CC(C)(C)NC(=O)Nc1ncnc2c1N=C[N]2 |
|
AD11280 | 4.05 | 355.85 | C19H20N6Cl | Clc1cccc(CCNc2nc(NC3CCCC3)nc3c2N=C[N]3)c1 |