aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30161 | -0.55 | 196.27 | C11H18O2N | CC(O)(C[NH2+]CCO)c1ccccc1 |
|
AD30162 | 0.12 | 180.22 | C8H16ONF2 | OCC[NH2+]C1CCC(F)(F)CC1 |
|
AD30163 | -0.7 | 184.26 | C10H18O2N | O=C1CC2CC([NH2+]CCO)CC2C1 |
|
AD30164 | 1.35 | 168.18 | C7H13NF3 | [NH3+]C1CCC(C(F)(F)F)CC1 |
|
AD30165 | -0.77 | 202.27 | C10H20O3N | OCC[NH2+]C1CCC2(CC1)OCCO2 |
|
AD30166 | 1.35 | 168.18 | C7H13NF3 | [NH3+]C1CCCC(C(F)(F)F)C1 |
|
AD30167 | -0.43 | 181.26 | C10H17ON2 | CC(Cc1ccccn1)[NH2+]CCO |
|
AD30168 | -0.11 | 188.29 | C10H22O2N | CCOC1CCC([NH2+]CCO)CC1 |
|
AD30169 | 1.15 | 178.25 | C11H16ON | [NH3+]C1CCOC(c2ccccc2)C1 |
|
AD30170 | -0.73 | 202.27 | C10H20O3N | CCOC(=O)C1CCC([NH2+]CCO)C1 |