aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07061 | 2.29 | 254.37 | C15H26O3 | CC1CCC(=O)C12CC(C(C)(C)O)CCC2(C)O |
|
AD07062 | 4.41 | 1369.24 | C69H67O17N11Cl2 | NCCCN(CCCN)CCCNC(=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 |
|
AD07063 | 1.39 | 191.23 | C11H13O2N | CNCC1=Cc2cc(O)ccc2OC1 |
|
AD07064 | 0.89 | 328.31 | C14H14O3N7 | Nc1nc(NC(CO)Cc2ccc([N+](=O)[O-])cc2)nc2c1N=C[N]2 |
|
AD07065 | 3.84 | 196.29 | C15H16 | CCc1ccc(Cc2ccccc2)cc1 |
|
AD07066 | 0.31 | 169.18 | C7H11O2N3 | COC(=O)NCCc1c[nH]cn1 |
|
AD07067 | 2.18 | 365.16 | C12H10N6I | Nc1nc2c(c(NCc3cccc(I)c3)n1)N=C[N]2 |
|
AD07068 | 3.06 | 255.11 | C11H11O2Br | COc1ccc(C=CC(C)=O)cc1Br |
|
AD07069 | 2.27 | 291.33 | C14H13O4NS | COC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1 |
|
AD07070 | 0.12 | 405.23 | C18H18O6N2Cl2 | NC(=O)COC1OC(C(=O)NCCc2ccc(Cl)cc2Cl)=CC(O)C1O |