aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12301 | 2.75 | 238.27 | C13H12N5 | Cc1ccc(C)c(Nc2ncnc3c2N=C[N]3)c1 |
|
AD12302 | 3.3 | 286.32 | C17H12N5 | Nc1nc(-c2cccc(-c3ccccc3)c2)nc2c1N=C[N]2 |
|
AD12303 | 1.29 | 590.8 | C30H58O9N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)CNC(C)C(O)C1(C)O |
|
AD12304 | 1.02 | 218.24 | C9H12N7 | CC(C)C=NNc1nc(N)c2c(n1)[N]C=N2 |
|
AD12305 | -0.68 | 144.22 | C7H16ON2 | OCCNC1CCCNC1 |
|
AD12306 | 8.43 | 833.08 | C52H67O6NP | CCC1CCCC(OC2CCC(N(C)CCC[P+](c3ccccc3)(c3ccccc3)c3ccccc3)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1 |
|
AD12307 | 2.18 | 254.24 | C15H10O4 | Cc1c(O)cc2c(c1O)C(=O)c1ccccc1C2=O |
|
AD12308 | 3.35 | 392.52 | C24H30O2N3 | O=C(C=Cc1ccc[nH+]c1)NCCCCC1CCN(C(=O)c2ccccc2)CC1 |
|
AD12309 | 7.84 | 469.8 | C29H59O3N | CCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)CCCCCC |
|
AD12310 | 2.32 | 510.72 | C28H50O6N2 | CCC1OC(=O)CC(O)C(C)C(O)C(CCN(C)CCCNC)CC(C)C(=O)C=CC(C)=CC1CO |