aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05651 | 0.36 | 197.22 | C7H7O2N3S | CSc1nc(N)c2c(n1)OCC2=O |
|
AD05652 | 2.76 | 201.27 | C13H15ON | NCCC(c1ccccc1)c1ccco1 |
|
AD05653 | 12.54 | 716.19 | C46H85O4N | CCCCCCC=CCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C=CCCC=C(C)C=CCCCCCCC |
|
AD05654 | 2.36 | 287.25 | C12H18O5NP | COP(=O)(NCC(=O)OC(C)C)Oc1ccccc1 |
|
AD05655 | 4.13 | 373.5 | C24H27ON3 | CNC(=O)c1ccc(N2CCC(NC(C)c3cccc4ccccc34)C2)cc1 |
|
AD05656 | 0.1 | 357.31 | C13H20O5N5P | COP(=O)(O)OC1CN(Cc2c[nH]c3c(N)ncnc23)CC1CO |
|
AD05657 | -0.26 | 95.05 | C2H3ONF2 | NC(=O)C(F)F |
|
AD05658 | 0.11 | 103.16 | C5H13ON | NCCCCCO |
|
AD05659 | 5.72 | 335.2 | C18H11N2Br | Brc1ccc2[nH]c3c(ccc4c5ccccc5[nH]c43)c2c1 |
|
AD05660 | 4.22 | 266.34 | C18H18O2 | C=CCc1ccc(O)c(-c2cc(CC=C)ccc2O)c1 |