aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08401 | 0.9 | 193.18 | C9H8ON3F | OCc1cn(-c2cccc(F)c2)nn1 |
|
AD08402 | 0.83 | 219.24 | C11H13O2N3 | COc1ccc(Cn2cc(CO)nn2)cc1 |
|
AD08403 | 2.28 | 378.43 | C21H22O3N4 | Cc1ccc(-n2nc(C(O)C(O)CO)c3nc4cc(C)c(C)cc4nc32)cc1 |
|
AD08404 | 0.78 | 115.18 | C6H13ON | CNC(=O)C(C)(C)C |
|
AD08405 | 7.74 | 1554.41 | C79H78O23N8Cl2 | CNC1C(=O)NC2Cc3ccc(cc3)Oc3cc4cc(c3OC3OC(C(=O)O)C(O)CC3NC(=O)CCCCCCCCC(C)C)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(cc(O)c2Cl)Oc2cc1ccc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)O)NC3=O |
|
AD08406 | 2.48 | 849.08 | C43H72O11N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)Cc3ccc(-c4cn(CCCCC(=O)NO)nn4)cc3)C2O)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O |
|
AD08407 | 0.42 | 134.13 | C5H10O4 | COCCOC(=O)OC |
|
AD08408 | 0.79 | 195.23 | C7H7ON4S | COc1nc(SC)nc2c1C=N[N]2 |
|
AD08409 | 0.04 | 546.62 | C28H38O9N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNCCCCc2ccc(-c3ccccc3)cc2)O1 |
|
AD08410 | 2.5 | 227.19 | C10H8N3F3 | Cn1cc(-c2ccc(C(F)(F)F)cc2)nn1 |