aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11291 | -0.22 | 100.08 | C2H4ON4 | [N-]=[N+]=NCC(N)=O |
|
AD11292 | -0.19 | 103.12 | C4H9O2N | NCCCC(=O)O |
|
AD11293 | 8.48 | 677.68 | C36H36O2N7Cl2S | Nc1sc2c(c1C(=O)c1ccc(Cl)c(Cl)c1)CCN(CCCCCCCCCOc1ccc(Nc3ncnc4c3N=C[N]4)cc1)C2 |
|
AD11294 | 9.35 | 681.79 | C41H54O2N4Cl2 | CC1(C)CCC2(C(=O)NCc3cn(-c4c(Cl)cccc4Cl)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD11295 | 4.62 | 414.54 | C22H38O7 | CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=O |
|
AD11296 | -4.05 | 307.35 | C12H25O6N3 | NC1CC(OC2C(N)CC(N)C(O)C2O)OC(CO)C1O |
|
AD11297 | 2.71 | 386.42 | C21H23O4N2F | C=CC1C(O)OC=C(C(=O)OC)C1CC1NCCc2c1[nH]c1cc(F)ccc21 |
|
AD11298 | 2.33 | 199.21 | C12H9O2N | O=C(O)C=Cc1ccnc2ccccc12 |
|
AD11299 | 4.11 | 546.75 | C32H50O7 | CC(=O)OC(C)(C)C=CC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(CC(O)C(O)C4(C)C)C3(C)CCC12C |
|
AD11300 | 4.84 | 433.47 | C26H19O2N5 | O=C1c2c(c3c4ccccc4[nH]c3c3[nH]c4ccccc4c23)C(=O)N1CCCn1ccnc1 |