aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40701 | -1.01 | 148.19 | C4H8O2N2S | COC(=O)CNC(N)=S |
|
AD40702 | -0.19 | 335.4 | C17H25O4N3 | CN(CCN1CCOCC1)C(=O)c1cccc(C(=O)NCCO)c1 |
|
AD40703 | 0.19 | 291.35 | C15H21O3N3 | CN(CCN1CCOCC1)C(=O)c1cccc(C(N)=O)c1 |
|
AD40704 | 0.88 | 363.16 | C8H8ON6SI | COCNC(=S)Nc1nc(I)nc2c1N=C[N]2 |
|
AD40705 | -0.57 | 314.36 | C13H18O5N2S | O=C(NCCO)c1cccc(S(=O)(=O)N2CCOCC2)c1 |
|
AD40706 | 0.12 | 322.39 | C14H18O3N4S | CS(=O)(=O)N1CCN(c2ccc3ccc(C(N)=O)cn23)CC1 |
|
AD40707 | -0.25 | 311.34 | C13H21O4N5 | CC(C)(C)OC(=O)N1CCn2nnc(C(=O)NCCO)c2C1 |
|
AD40708 | 0.89 | 332.39 | C15H16O3N4S | NC(=O)c1ncn2c1CN(CC1CC1)S(=O)(=O)c1ccccc1-2 |
|
AD40709 | 0.03 | 335.39 | C14H17O3N5S | Cc1nc(CN2CCn3cnc(C(=O)NCCO)c3C2=O)cs1 |
|
AD40710 | 0.4 | 291.34 | C12H13O2N5S | Cc1nc(CN2CCn3cnc(C(N)=O)c3C2=O)cs1 |