aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15021 | 2.14 | 236.26 | C13H10N5 | Nc1nc(C=Cc2ccccc2)nc2c1N=C[N]2 |
|
AD15022 | 0.37 | 95.1 | C5H5ON | O=c1cc[nH]cc1 |
|
AD15023 | 5.21 | 695.77 | C39H41O9N3 | CC(C(=O)NCCc1ccccc1)N(CC(=O)NC(CCC(=O)O)C(=O)O)C(=O)CCc1ccc(Oc2ccc(Oc3ccccc3)cc2)cc1 |
|
AD15024 | 1.9 | 404.5 | C23H32O6 | CC12CCC3C(CCC4(O)CCC(O)CC34C=O)C1(O)CCC2C1=CC(=O)OC1 |
|
AD15025 | -3.48 | 323.3 | C12H21O9N | CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)CC(O)CO |
|
AD15026 | 12.52 | 522.94 | C35H70O2 | CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C(=O)OC |
|
AD15027 | 1.24 | 166.18 | C9H10O3 | COC(=O)COc1ccccc1 |
|
AD15028 | 1.06 | 174.21 | C9H10N4 | Cn1cc(-c2ccc(N)cc2)nn1 |
|
AD15029 | 3.84 | 287.77 | C15H10N3ClS | Clc1ccccc1Cc1nnc(-c2cccnc2)s1 |
|
AD15030 | 0.93 | 142.18 | C5H6ON2S | CC(=O)c1cnc(N)s1 |