aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18481 | 4.33 | 383.46 | C18H19O2N6S | O=[N+]([O-])c1ccc(CSc2nc(NC3CCCCC3)nc3c2N=C[N]3)cc1 |
|
AD18482 | 2.64 | 376.41 | C20H24O7 | COc1cc(CC(CO)c2cc(C(C)=O)cc(OC)c2O)cc(OC)c1O |
|
AD18483 | 0.28 | 328.32 | C15H20O8 | COC(=O)C1=COC(O)C2C1C(OC(C)=O)CC2(C)OC(C)=O |
|
AD18484 | 6.12 | 657.95 | C18H10N8Br4 | Brc1cc(Br)c2ncnc(NN=CC=NNc3ncnc4c(Br)cc(Br)cc34)c2c1 |
|
AD18485 | 2.16 | 279.34 | C15H21O4N | COC(=O)c1cccc(CN(C)CCCCC(=O)O)c1 |
|
AD18486 | 2.07 | 265.31 | C14H19O4N | CN(CCCCC(=O)O)Cc1cccc(C(=O)O)c1 |
|
AD18487 | 0.33 | 288.31 | C14H16O3N4 | COC(=O)C(Cc1ccccc1)NC(=O)c1cn(C)nn1 |
|
AD18488 | 1.04 | 133.15 | C7H7N3 | Cc1cc2ncccn2n1 |
|
AD18489 | 1.52 | 270.29 | C15H14O3N2 | NC(=O)CN(C(=O)c1ccc(O)cc1)c1ccccc1 |
|
AD18490 | 12.34 | 632.05 | C39H69O3NS | CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)CNC(=O)c1cc(CS)cc(C(=O)O)c1 |