aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18341 | 4.14 | 305.39 | C17H13N4S | Cc1ccc2ccccc2c1CSc1ncnc2c1N=C[N]2 |
|
AD18342 | 3.19 | 260.26 | C15H13O3F | COCc1ccc(C(=O)Oc2ccc(F)cc2)cc1 |
|
AD18343 | -0.67 | 356.24 | C14H12O11 | O=C(O)CC(C(=O)O)C1c2c(C(=O)O)cc(O)c(O)c2OC(=O)C1O |
|
AD18344 | 4.53 | 632.84 | C36H56O9 | CCOC(=O)C1=CC(C)C(O)C2OCC(=CC=CC(C)C(O)C(C)=CCC3CC(O)CC4(CCC(C)C(C(C)CC)O4)O3)C12O |
|
AD18345 | 7.07 | 468.72 | C31H48O3 | C=C(C)C=CCC(C)C1CCC2(C)C3C=CC45OC(OC)C3(CCC12C)C4CCC(O)C5(C)C |
|
AD18346 | 3.93 | 317.14 | C15H9O3Br | O=c1c(O)c(-c2ccc(Br)cc2)oc2ccccc12 |
|
AD18347 | 5.01 | 310.36 | C20H14N4 | c1ccc2c(Nc3ccc4[nH]cnc4c3)c3ccccc3nc2c1 |
|
AD18348 | 0.51 | 578.61 | C29H38O12 | CCC(=CC(=O)OC1C(=O)OC2CC3C(C)C(=O)C(O)=CC3(C)C3C(O)C(O)C4(C(=O)OC)OCC23C14)C(C)(C)O |
|
AD18349 | 3.03 | 320.47 | C20H32O3 | C=C1C2CCC3CC2(CCC2(O)C1CC(O)C2(C)C)CC3(C)O |
|
AD18350 | 5.69 | 453.54 | C25H31O5N3 | COC(=O)CCCCCCCCCCNc1ccc([N+](=O)[O-])c2[nH]c3ccccc3c(=O)c12 |