aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31521 | 0.66 | 126.22 | C8H16N | CC1(C)C2CC([NH3+])CC21 |
|
AD31522 | -0.2 | 116.18 | C6H14ON | [NH3+]C1CCCOCC1 |
|
AD31523 | -0.88 | 212.2 | C9H12O4N2 | O=C(CNC(=O)c1ccco1)NCCO |
|
AD31524 | 0.59 | 196.27 | C9H12ON2S | NC(=O)CN1CCc2sccc2C1 |
|
AD31525 | -0.1 | 205.2 | C8H9ON6 | CCC(=O)n1c(N)c2c(nc1=N)[N]C=N2 |
|
AD31526 | 0.87 | 220.19 | C9H7ON5F | O=C(Nc1nc(F)nc2c1N=C[N]2)C1CC1 |
|
AD31527 | -0.01 | 219.2 | C9H9O2N5 | O=C(Nc1ncnc2[nH]c(=O)[nH]c12)C1CC1 |
|
AD31528 | 1.51 | 199.64 | C10H10O2NCl | Cc1cc(Cl)ccc1OCC(N)=O |
|
AD31529 | 0.83 | 193.2 | C10H11O3N | NC(=O)CCc1ccc2c(c1)OCO2 |
|
AD31530 | -1.92 | 216.24 | C9H16O4N2 | CC(=O)N1CC(O)CC1C(=O)NCCO |