aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40271 | -0.12 | 101.15 | C5H11ON | C=CC(C)(O)CN |
|
AD40272 | 1.89 | 270.37 | C14H26O3N2 | CC(C)(C)OC(=O)N1CCOC2(CCC(N)CC2)C1 |
|
AD40273 | 2.06 | 274.3 | C13H10O3N2S | N#Cc1ccccc1S(=O)(=O)Nc1ccc(O)cc1 |
|
AD40274 | 1.51 | 312.33 | C14H10O2N5S | N#Cc1ccc(CS(=O)(=O)Nc2ncnc3c2C=C[N]3)cc1 |
|
AD40275 | 2.28 | 268.28 | C11H19O2N2F3 | CC(C)(C)OC(=O)N1CCC(N)CC1C(F)(F)F |
|
AD40276 | -0.44 | 138.17 | C6H10N4 | C=CC[NH2+]CC1=C[N]N=N1 |
|
AD40277 | -0.44 | 116.18 | C6H14ON | C=CCCC(O)C[NH3+] |
|
AD40278 | 1.26 | 236.19 | C9H7O2N5F | C=CCOC(=O)Nc1nc(F)nc2c1N=C[N]2 |
|
AD40279 | 0.28 | 97.12 | C5H7ON | N#CC1CC(O)C1 |
|
AD40280 | 0.67 | 111.14 | C6H9ON | N#CC1CCC(O)C1 |