aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37021 | -2.31 | 260.31 | C11H22O4N3 | CC([NH3+])C(=O)N1C(C(=O)NCCO)COC1(C)C |
|
AD37022 | -1.21 | 276.36 | C15H22O2N3 | O=C(NCCO)C12C[NH2+]CC1CN(c1ccccc1)C2 |
|
AD37023 | -0.92 | 264.35 | C14H22O2N3 | O=C(NCCO)C1(Cc2ccccn2)CC[NH2+]CC1 |
|
AD37024 | -0.78 | 261.34 | C12H25O4N2 | CC(C)(C)OC(=O)CCC([NH3+])CC(=O)NCCO |
|
AD37025 | -2.39 | 266.32 | C12H20O2N5 | O=C(NCCO)C1Cn2cnnc2C12CC[NH2+]CC2 |
|
AD37026 | -0.86 | 268.34 | C13H22O3N3 | [NH3+]C1CCN(C(C(=O)NCCO)c2ccco2)CC1 |
|
AD37027 | -1.78 | 265.34 | C13H21O2N4 | O=C(NCCO)C1Cn2ccnc2C12CC[NH2+]CC2 |
|
AD37028 | -1.3 | 268.34 | C13H22O3N3 | O=C(NCCO)C(c1ccco1)N1CCC[NH2+]CC1 |
|
AD37029 | -2.52 | 277.37 | C11H21O4N2S | O=C(NCCO)C1C[NH2+]CC12CCS(=O)(=O)CC2 |
|
AD37030 | -0.92 | 264.35 | C14H22O2N3 | O=C(NCCO)C1(Cc2cccnc2)CC[NH2+]CC1 |