aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40651 | 0.62 | 295.34 | C13H21O3N5 | CCn1nnc2c1C(C(N)=O)CN(C(=O)OC(C)(C)C)C2 |
|
AD40652 | -0.26 | 307.35 | C14H21O3N5 | CN(C)C(=O)N1CCC2(CC1)OC(C(N)=O)Cn1ccnc12 |
|
AD40653 | -0.64 | 351.41 | C16H25O4N5 | CN(C)C(=O)N1CCC2(CC1)OC(C(=O)NCCO)Cn1ccnc12 |
|
AD40654 | 1.17 | 306.34 | C14H14O4N2S | NC(=O)CCC(=O)c1ccn(S(=O)(=O)c2ccccc2)c1 |
|
AD40655 | -0.07 | 314.34 | C16H18O3N4 | O=C(NC(Cc1ccccc1)C(=O)NCCO)c1cnccn1 |
|
AD40656 | 1.08 | 293.39 | C14H19O2N3S | CC(=O)N1CCN(CC(=O)Nc2ccc(S)cc2)CC1 |
|
AD40657 | -0.78 | 313.35 | C14H23O5N3 | CC(C)(C)OC(=O)N1CC2(CC(=O)NC2C(=O)NCCO)C1 |
|
AD40658 | -0.1 | 304.37 | C12H20O5N2S | CC(C)(C)OC(=O)N1CC2(C1)C(C(N)=O)CCS2(=O)=O |
|
AD40659 | -0.48 | 348.42 | C14H24O6N2S | CC(C)(C)OC(=O)N1CC2(C1)C(C(=O)NCCO)CCS2(=O)=O |
|
AD40660 | 0.64 | 300.4 | C12H16O3N2S2 | O=C(CN1CCS(=O)(=O)CC1)Nc1ccc(S)cc1 |