aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01891 | 4.6 | 533.48 | C29H31O2N4FCl2 | CNC(=O)CCc1cc(Cl)c(CN2CC(F)CC2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl |
|
AD01892 | -0.63 | 416.22 | C11H18O11N2P2 | COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)O |
|
AD01893 | 4.97 | 592.59 | C30H35O3N5Cl2S | CNC(=O)NCCCCOc1cc(Cl)c(CN2CSCC2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl |
|
AD01894 | 3.14 | 554.68 | C30H36O2N9 | O=C(NCCNC(=O)c1nc2c(c(NCC(c3ccccc3)c3ccccc3)n1)N=C[N]2)NCCN1CCCCC1 |
|
AD01895 | -1.98 | 216.24 | C9H16O4N2 | CN(C)C1=NC2C(O)C(O)C(CO)C2O1 |
|
AD01896 | 2.47 | 202.21 | C12H10O3 | CC(=O)Oc1cc2ccccc2cc1O |
|
AD01897 | 4.51 | 319.78 | C19H12N4Cl | Clc1ccc(Nc2ncnc3c2C(c2ccccc2)=C[N]3)cc1 |
|
AD01898 | 5.82 | 611.6 | C33H32O3N4Cl2S | CNC(=O)c1ccc(COc2cc(Cl)c(CN3CSCC3C(=O)N3CCN(C4CC4)c4ccccc43)cc2Cl)cc1 |
|
AD01899 | -1.0 | 151.13 | C5H5ON5 | Nc1nn2ccnc2c(=O)[nH]1 |
|
AD01900 | 1.47 | 195.27 | C10H17ON3 | CCCCCCc1c[nH]c(=O)nc1N |