aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12011 | -1.66 | 180.19 | C7H10ON5 | OCCNC1=NCNC2=C1N=C[N]2 |
|
AD12012 | 0.77 | 254.31 | C10H14O2N4S | CSc1nc(N)c(N=C(C)C(C)=O)c(=O)n1C |
|
AD12013 | 1.18 | 187.11 | C7H8O4P | COP(=O)([O-])Oc1ccccc1 |
|
AD12014 | 3.5 | 332.41 | C20H20ON4 | C=NN=c1[nH]nc(-c2ccc(C)cc2)cc1Cc1ccccc1OC |
|
AD12015 | 1.67 | 102.14 | C8H6 | C#Cc1ccccc1 |
|
AD12016 | 3.29 | 327.32 | C15H22O5NP | CCOC(=O)C1(NP(=O)(OC)Oc2ccccc2)CCCC1 |
|
AD12017 | 0.52 | 257.23 | C12H9O3N4 | O=c1[nH]c2c(c(=O)[nH]1)N=C(OCc1ccccc1)[N]2 |
|
AD12018 | 10.48 | 694.14 | C43H83O5N | CCCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CC=CCCCCC1CC1CCCC |
|
AD12019 | 5.36 | 516.72 | C31H48O6 | CC(=O)OC1CC(O)C2(C)C(CCC3(C)C2CC=C2C4CC(C)(C(=O)O)CCC4(C)CCC23C)C1CO |
|
AD12020 | 6.26 | 514.75 | C32H50O5 | CC(=O)OC(C)(C)C1OC23CC4(C)C5CCC6C(C)(C)C(O)CCC67CC57CCC4(C)C2C(C)CC1O3 |