aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23951 | -0.52 | 258.26 | C12H12O2N5 | Cc1cc2nc3c(=O)[nH]c(=O)[nH]c3[n+](C)c2cc1N |
|
AD23952 | 0.08 | 524.42 | C15H30O12N2P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(C)C(=O)O |
|
AD23953 | 4.45 | 648.69 | C25H50O11N2P2S | CCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD23954 | 0.73 | 260.02 | C5H3N5I | Nc1ncnc2c1N=C(I)[N]2 |
|
AD23955 | 0.63 | 480.41 | C14H30O10N2P2S | CCSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD23956 | 3.41 | 430.48 | C21H35O7P | COP(=O)(O)OC(=O)C1(C)CCCC2(C)C1CC(O)C13CC(CCC21)C(C)(O)C3 |
|
AD23957 | 3.43 | 428.46 | C21H33O7P | COP(=O)(O)OC(=O)C1(C)CCCC2(C)C1CC(O)C13CC4CC(OC4(C)C1)C23 |
|
AD23958 | 5.01 | 343.86 | C20H22ON3Cl | C=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc(Cl)c(N)c2)c1 |
|
AD23959 | 4.39 | 194.28 | C15H14 | CC=Cc1ccc(-c2ccccc2)cc1 |
|
AD23960 | 5.14 | 344.84 | C20H21O2N2Cl | C=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc(Cl)c(O)c2)c1 |