aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14521 | -5.62 | 435.48 | C17H33O8N5 | CNC1C(O)OC2CC(NC(=O)CN)C(OC3C(N)CC(N)C(O)C3O)OC2C1O |
|
AD14522 | 1.74 | 1109.5 | C54H53O17N8Cl | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3cccc(c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD14523 | 1.41 | 648.88 | C33H64O10N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(C)C)C2O)C(C)(O)CC(C)C(OCCN)C(C)C(O)C1(C)O |
|
AD14524 | 0.8 | 125.13 | C6H7O2N | Cc1nccc(O)c1O |
|
AD14525 | 2.71 | 974.7 | C39H41O18N6P3 | COP(=O)(O)OC1C2C(n3cc(C)c(N)nc3=O)OC1(COP(=O)(O)OC1CC(n3cc(C)c(=O)[nH]c3=O)OC1COP(=O)(O)O)CN2C(=O)c1ccc2ccc3cccc4ccc1c2c34 |
|
AD14526 | 0.44 | 192.2 | C8H10ON5 | COCCNc1ncnc2c1N=C[N]2 |
|
AD14527 | 0.75 | 251.33 | C13H21O2N3 | CN(CCCc1ccccn1)CCC(N)C(=O)O |
|
AD14528 | 2.47 | 300.26 | C12H13ON5F3 | Nc1nc(OC2CCC(C(F)(F)F)CC2)nc2c1N=C[N]2 |
|
AD14529 | 1.56 | 232.27 | C10H14N7 | CCC(CC)=NNc1nc(N)c2c(n1)[N]C=N2 |
|
AD14530 | 0.57 | 88.11 | C4H8O2 | CC(C)OC=O |