aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00301 | 3.2 | 348.41 | C20H20O2N4 | C=NN=c1[nH]nc(-c2ccc(OC)cc2)cc1Cc1ccccc1OC |
|
AD00302 | -1.78 | 630.68 | C29H39O7N8F | NC1CC(NCc2cn(CC(O)CN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C4CC4)CC3)nn2)C(O)C(O)C1O |
|
AD00303 | -5.21 | 308.26 | C11H18O9N | CC(=O)NC1C(O)CC(O)(C(=O)[O-])OC1C(O)C(O)CO |
|
AD00304 | 1.54 | 194.27 | C12H18O2 | OCCCc1cccc(CCCO)c1 |
|
AD00305 | -0.16 | 192.0 | CH6O7P2 | COP(=O)(O)OP(=O)(O)O |
|
AD00306 | 0.43 | 128.16 | C4H4ON2S | O=c1cc[nH]c(=S)[nH]1 |
|
AD00307 | 1.41 | 124.14 | C7H8O2 | Cc1cc(O)ccc1O |
|
AD00308 | 0.71 | 200.23 | C10H16O4 | C=CC(C)(O)CCC=C(CO)C(=O)O |
|
AD00309 | 6.2 | 472.71 | C30H48O4 | CC1(C)CCC2(C(=O)O)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD00310 | 0.81 | 604.78 | C30H56O10N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)NC(=O)C(C)C(O)C1(C)O |