aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04371 | 2.32 | 245.28 | C14H15O3N | Oc1ccc(CNOCc2ccccc2)cc1O |
|
AD04372 | 1.51 | 335.36 | C17H21O6N | CCOc1ccc(C2=C(OCC(=O)NC)COC2=O)cc1OCC |
|
AD04373 | 3.31 | 292.37 | C17H18N5 | C1=Nc2c(ncnc2NCC2CCCCc3ccccc32)[N]1 |
|
AD04374 | 0.54 | 267.99 | C2H7O9P3 | C=CP(=O)(O)OP(=O)(O)OP(=O)(O)O |
|
AD04375 | 2.69 | 327.42 | C20H25O3N | CC1OC(O)CC(C)(NCc2ccc(-c3ccccc3)cc2)C1O |
|
AD04376 | 9.01 | 860.52 | C51H54O6N3ClS | CCN(CCCCOc1ccc(Cc2ccccc2Cl)cc1)C(=O)Cc1ccc2c(c1)C(C)(C)C1=C3C=C4C5=[N+](CCC4OC3CCN12)c1ccc(S(=O)(=O)[O-])cc1C5(C)C |
|
AD04377 | 4.01 | 318.46 | C20H30O3 | C=C1CC23CC1CCC2C1(C)CCCC(C)(C(=O)O)C1CC3O |
|
AD04378 | -1.07 | 137.1 | C5H3O2N3 | N#Cc1c[nH]c(=O)[nH]c1=O |
|
AD04379 | -0.48 | 368.39 | C17H24O7N2 | CCOC(=O)CCN1C(=O)C2CCC3C(=NO)CC(O)C(O)C3C2C1=O |
|
AD04380 | 0.81 | 486.66 | C23H46O5N6 | CCCCCCCCCCC(=O)NC(CCCNC(=N)N)C(=O)NCCCNC(CO)C(=O)O |