aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07081 | 0.16 | 261.3 | C9H15O4N3S | COS(=O)(=O)NC(=O)c1cc(C(C)C)nn1C |
|
AD07082 | 9.06 | 860.52 | C51H54O6N3ClS | CC1(C)C2=C3C=C4C5=[N+](CCC4OC3CCN2c2ccc(CC(=O)NCCCCCCOc3ccc(Cc4ccccc4Cl)cc3)cc21)c1ccc(S(=O)(=O)[O-])cc1C5(C)C |
|
AD07083 | -0.32 | 269.32 | C9H19O6NS | COC(C(=O)NS(=O)(=O)OC)C(OC)C(C)C |
|
AD07084 | 2.48 | 232.31 | C12H18N5 | CC(C)C(Nc1ncnc2c1N=C[N]2)C(C)C |
|
AD07085 | 0.69 | 98.1 | C4H6ON2 | Cc1nnc(C)o1 |
|
AD07086 | 2.11 | 314.25 | C16H10O7 | O=COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1 |
|
AD07087 | 2.73 | 301.37 | C15H21ON6 | CCNc1nc(NC(=O)CC2CCCCC2)nc2c1N=C[N]2 |
|
AD07088 | -1.6 | 160.22 | C7H16O2N2 | CC1C(O)C(N)CC(N)C1O |
|
AD07089 | 0.63 | 159.23 | C8H17O2N | CC(=O)N(C)CCCCCO |
|
AD07090 | 1.5 | 302.32 | C14H22O7 | CCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=O |