aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21651 | -1.03 | 207.17 | C7H7O2N6 | Nc1ncnc2c1N=C(NCC(=O)O)[N]2 |
|
AD21652 | 1.85 | 168.24 | C10H16O2 | CC(C)=CC(=O)C=C(C)CCO |
|
AD21653 | 3.01 | 577.64 | C28H28O4N7FS | O=C(Cn1cc(CN2CCN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)nn1)Nc1ccc(S)cc1 |
|
AD21654 | 3.08 | 590.76 | C32H50O8N2 | CCC(=O)OC1CC(=O)NC(C)CN(CCCCc2ccccc2)CC(OC(C)=O)C(C)CC(CC=O)C(O)C1OC |
|
AD21655 | 1.56 | 281.38 | C13H19O2N3S | CSCCNCC1Cc2ccc([N+](=O)[O-])cc2CN1 |
|
AD21656 | -0.58 | 136.11 | C5H4ON4 | O=c1[nH]cnn2ccnc12 |
|
AD21657 | 10.43 | 714.92 | C34H68O9P2S | CCCCCCCCCCCCCCCCSCC(COP(=O)([O-])OP(=O)([O-])OC)OC(=O)CCCCCCCCCCCCC |
|
AD21658 | 5.73 | 503.72 | C30H49O5N | CC1(C)CCC2(C(=O)O)CCC3(C)C(C(=NO)CC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD21659 | 0.31 | 94.5 | C3H3O2Cl | O=C(O)CCl |
|
AD21660 | 2.52 | 302.28 | C16H14O6 | COc1cc(O)cc(C2CC(=O)c3c(O)cc(O)cc3O2)c1 |