aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07201 | 2.28 | 393.17 | C13H10ON6I | CNc1nc2c(c(NC(=O)c3cccc(I)c3)n1)N=C[N]2 |
|
AD07202 | 2.07 | 207.06 | C9H8ON2Cl2 | CCNC(=O)c1[nH]cc(Cl)c1Cl |
|
AD07203 | 5.42 | 446.67 | C28H46O4 | COC1CC2C(CCC3CC(O)CCC32C)C2CC3OC4(CCC(C)CO4)C(C)C3C12C |
|
AD07204 | 5.94 | 270.46 | C17H34O2 | CCCCCCCCCCCCCCCCC(=O)O |
|
AD07205 | 2.91 | 337.75 | C13H8O3N5ClS | O=[N+]([O-])c1ccc(CSc2nc(O)c3nc[nH]c3n2)c(Cl)c1 |
|
AD07206 | 0.55 | 152.98 | C3H5O2Br | COC(=O)CBr |
|
AD07207 | 4.84 | 406.46 | C22H18O4N2S | CCOC(=O)c1c(-c2ccccc2)[nH]c(=S)c(C#N)c1-c1ccc(O)c(OC)c1 |
|
AD07208 | -0.07 | 403.18 | C6H16O11NP3S | NC(CCSCCP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(=O)O |
|
AD07209 | 4.3 | 434.66 | C27H46O4 | CC(CO)CCCC(C)C1C(O)CC2C3C(O)C=C4CC(O)CCC4(C)C3CCC21C |
|
AD07210 | 3.89 | 1035.11 | C55H62O16N4 | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)CCCc3cn(CCO)nn3)C(NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |