aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD29531 | 1.16 | 208.27 | C8H10N5S | CSCCNc1ncnc2c1N=C[N]2 |
|
AD29532 | 0.26 | 187.22 | C6H9O2N3S | O=C(NCCO)Nc1nccs1 |
|
AD29533 | 1.23 | 214.25 | C11H12N5 | C1=Nc2c(ncnc2N2CCC3CC3C2)[N]1 |
|
AD29534 | 1.69 | 177.19 | C8H13ONF2 | NC(=O)CC1CCC(F)(F)CC1 |
|
AD29535 | 1.91 | 214.25 | C11H12N5 | C1=Nc2c(ncnc2NCC2=CCCC2)[N]1 |
|
AD29536 | 0.7 | 195.26 | C11H17O2N | CC1(C(=O)NCCO)CC2C=CC1C2 |
|
AD29537 | 0.92 | 197.28 | C11H19O2N | O=C(CC1CC2CCC1C2)NCCO |
|
AD29538 | 1.37 | 214.25 | C11H12N5 | CC12CC(CN1c1ncnc3c1N=C[N]3)C2 |
|
AD29539 | 1.58 | 163.22 | C10H13ON | Cc1ccc(C(C)C(N)=O)cc1 |
|
AD29540 | 1.67 | 163.22 | C10H13ON | CC(CC(N)=O)c1ccccc1 |