aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03251 | 0.58 | 202.21 | C11H10O2N2 | O=c1cc[nH]c(=O)n1Cc1ccccc1 |
|
AD03252 | 1.76 | 90.19 | C4H10S | CCCSC |
|
AD03253 | 2.58 | 302.54 | C8H9O7P2Cl | COP(=O)(O)OP(=O)(O)Oc1cccc(Cl)c1 |
|
AD03254 | 1.96 | 225.23 | C12H9ON4 | C1=Nc2c(ncnc2OCc2ccccc2)[N]1 |
|
AD03255 | 2.04 | 130.19 | C7H14O2 | CCCCCCC(=O)O |
|
AD03256 | 0.67 | 476.43 | C23H24O11 | O=C(C=Cc1ccc(O)c(O)c1)OC1C(CO)OC2OCC(c3ccc(O)c(O)c3)OC2C1O |
|
AD03257 | -3.45 | 1048.27 | C42H63O10N16S3 | Cc1c(N)nc(C(CC(N)=O)NCC(N)C(N)=O)nc1C(=O)NC(C(=O)NC(C)C(O)C(C)C(=O)NC(C(=O)NCCc1nc(-c2nc(C(=O)NCCC[S+](C)C)cs2)cs1)C(C)O)C(O)c1c[nH]cn1 |
|
AD03258 | 6.41 | 491.95 | C21H42O7P2Cl | CCCCCCCCCCCCCCCCOCC(Cl)CP(=O)([O-])OP(=O)(O)OC |
|
AD03259 | 1.51 | 244.77 | C13H21ON2Cl | CC(Cl)CNC(=O)C1NCC1CCC1CC1 |
|
AD03260 | 3.05 | 254.31 | C14H10ON2S | O=c1c2ccccc2[nH]c(=S)n1-c1ccccc1 |