aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01831 | 1.97 | 1657.59 | C81H91O21N15Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NC(=O)CNC(=O)C(Cc4c[nH]c5ccccc45)NC(=O)C(N)CCCCN)c4cc(O)cc(O)c4-c4cc3ccc4O)C(OC3CC(C)(N)C(O)C(C)O3)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD01832 | -2.93 | 639.76 | C28H49O8N9 | CC(NC(=O)C(NC(=O)C(NC(=O)C1CCCN1)C(C)O)C(C)C)C(=O)N1CCCC1C(=O)NC(CCCNC(=N)N)C(=O)O |
|
AD01833 | -1.02 | 217.17 | C8H5O2N6 | Nc1ncnc2c1-c1c([nH]c(=O)[nH]c1=O)[N]2 |
|
AD01834 | 0.11 | 144.22 | C7H16ON2 | CCC(C)C(N)C(=O)NC |
|
AD01835 | -0.93 | 142.11 | C5H6O3N2 | COc1c[nH]c(=O)[nH]c1=O |
|
AD01836 | 2.55 | 266.31 | C13H8N5S | N#Cc1ccccc1CSc1ncnc2c1N=C[N]2 |
|
AD01837 | 3.0 | 607.8 | C33H49O4N7 | CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(N)C(C)C)ccc21 |
|
AD01838 | 4.36 | 330.51 | C19H38O4 | CCCCCCCCCCCCCCCC(=O)OCC(O)CO |
|
AD01839 | 5.28 | 782.93 | C42H58O12N2 | COC(=O)NC1C(C)OC(OC2CC=C(C)C3C=CC4C(O)C(C)CC(C)C4C3(C)C(=O)C3=C(O)C4(CC(C)C(CO)=CC4C=C2C)OC3=O)CC1(C)[N+](=O)[O-] |
|
AD01840 | 1.08 | 182.59 | C7H5N5Cl | CNc1nc(Cl)nc2c1N=C[N]2 |