aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17221 | -1.01 | 845.06 | C40H68O8N12 | CCC(C)C(NC(=O)C(Cc1ccccc1)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CC1CCCCC1)NC(=O)C(N)C(C)O)C(=O)O |
|
AD17222 | 2.44 | 187.56 | C8H2N2F2Cl | Fc1cc2c(cc1F)N=C(Cl)[N]2 |
|
AD17223 | 3.11 | 470.61 | C28H38O6 | CC1=C(CO)C(=O)OC(C(CO)C2CCC3C4CC=C5CC=CC(=O)C5(C)C4CC(O)C23C)C1 |
|
AD17224 | 1.21 | 367.44 | C18H23ON8 | COc1ccccc1N1CCN(CCNc2nc(N)c3c(n2)[N]C=N3)CC1 |
|
AD17225 | 1.32 | 368.42 | C18H22O2N7 | COCCOc1ccc(N2CCN(c3nc(N)c4c(n3)[N]C=N4)CC2)cc1 |
|
AD17226 | 7.74 | 719.02 | C44H66O6N2 | CCC1OC(=O)CC(O)C(C)C(O)C(CCN2CC(C)CC(C)C2)CC(C)C(=NOCCCCc2ccc3ccccc3c2)C=CC(C)=CC1CO |
|
AD17227 | 3.69 | 424.45 | C19H22O3N9 | O=[N+]([O-])c1ccc(NCCCCCCCCNc2ncnc3c2N=C[N]3)c2nonc12 |
|
AD17228 | -3.21 | 307.3 | C12H21O8N | CC(=O)NC1C(O)CC(O)(C(=O)O)CC1C(O)C(O)CO |
|
AD17229 | -1.53 | 726.62 | C23H32O13N6P2S2 | COP(O)(=S)OC1C2OCC1(COP(O)(=S)OC1C3OCC1(CO)OC3n1cc(C)c(N)nc1=O)OC2n1cc(C)c(N)nc1=O |
|
AD17230 | -3.01 | 1019.81 | C31H40O20N7P3S3 | Cc1cn(C2CC(OP(O)(=S)OCC34COC(C(n5cc(C)c(=O)[nH]c5=O)O3)C4OP(O)(=S)OCC34COC(C(n5ccc(N)nc5=O)O3)C4O)C(COP(O)(O)=S)O2)c(=O)[nH]c1=O |