aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10051 | 4.74 | 1326.17 | C67H62O17N10Cl2 | NCCCCNCCCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD10052 | 1.6 | 262.35 | C15H22O2N2 | CCN(CC(=O)NC)C(=O)CCCc1ccccc1 |
|
AD10053 | 3.42 | 419.56 | C24H37O5N | C=C1CC23CCC4C(C)(C(=O)OC(CCN)C(=O)O)CCCC4(C)C2CCC1(O)C3 |
|
AD10054 | 2.68 | 334.36 | C17H16ON7 | CCNc1nc(-n2cc(-c3ccc(OC)cc3)cn2)nc2c1N=C[N]2 |
|
AD10055 | 1.17 | 274.3 | C13H16O2N5 | CCOC(=O)C1CCCN(c2ncnc3c2N=C[N]3)C1 |
|
AD10056 | 3.66 | 446.63 | C27H42O5 | CC1CCC2(OC1)OC1C(O)C3C4CC=C5CC(O)C(O)CC5(C)C4CCC3(C)C1C2C |
|
AD10057 | -1.52 | 318.33 | C13H22O7N2 | COC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(=O)OC |
|
AD10058 | -0.89 | 164.17 | C7H8ON4 | CN1C=CC2=NC(N)=NC(=O)C21 |
|
AD10059 | -0.3 | 188.23 | C8H16O3N2 | CC(=O)NC(CCCCN)C(=O)O |
|
AD10060 | -0.51 | 992.04 | C46H65O19N5 | Cc1cc(COC(=O)NC2(C)CC(O)OC(C)C2O)cc(C)c1OC(=O)CNC(=O)CC(NC(=O)COCCO)C(=O)NCC(=O)Oc1c(C)cc(COC(=O)NC2(C)CC(O)OC(C)C2O)cc1C |