aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD02601 | 0.08 | 253.29 | C9H11O2N5S | COc1nc(N)c(-c2csc(N)n2)c(=O)n1C |
|
AD02602 | -1.12 | 557.18 | C10H19O14N5P4 | Nc1ncnc2c1ncn2C1CC(OP(=O)(O)O)C(CO[PH](O)(O)OP(=O)(O)P(=O)(O)O)O1 |
|
AD02603 | 2.58 | 270.24 | C15H10O5 | O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12 |
|
AD02604 | -0.28 | 235.99 | C4H3ON3I | NC(=O)C1=N[N]C=C1I |
|
AD02605 | 1.43 | 234.21 | C12H10O5 | Cc1c(O)ccc2c(CC(=O)O)cc(=O)oc12 |
|
AD02606 | -0.42 | 303.27 | C14H13O5N3 | COC(=O)C1C=CC(O)n2c(=O)n(-c3ccccc3)c(=O)n21 |
|
AD02607 | -0.91 | 340.2 | C10H14O8N2FP | COP(=O)(O)OCC1OC(n2cc(F)c(=O)[nH]c2=O)CC1O |
|
AD02608 | 1.11 | 170.16 | C8H10O4 | COc1cc(O)cc(OC)c1O |
|
AD02609 | 0.57 | 361.25 | C11H16O7N5P | COP(=O)(O)OCC1OC(n2cc(C)c(=O)[nH]c2=O)CC1N=[N+]=[N-] |
|
AD02610 | 1.24 | 133.15 | C8H7ON | N#CC(O)c1ccccc1 |