aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04391 | 2.94 | 296.44 | C12H18N5S2 | Nc1nc(SCCCCCCCS)nc2c1N=C[N]2 |
|
AD04392 | 2.29 | 316.27 | C16H12O7 | COc1c(O)cc2oc(-c3ccc(O)cc3)c(O)c(=O)c2c1O |
|
AD04393 | 2.59 | 300.27 | C16H12O6 | COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O |
|
AD04394 | 2.34 | 350.41 | C16H14N8S | Cc1ccc(-n2c(Cn3nnc(-c4cccnc4)n3)n[nH]c2=S)cc1 |
|
AD04395 | 2.91 | 234.28 | C12H10O3S | COC(=O)c1csc(-c2ccc(O)cc2)c1 |
|
AD04396 | 1.65 | 156.12 | C7H9O2P | O=[PH](O)Cc1ccccc1 |
|
AD04397 | 0.62 | 275.13 | C6H15O7NP2 | COP(=O)(O)OP(=O)(O)OCC1CCCN1 |
|
AD04398 | 2.7 | 436.55 | C24H36O7 | COC1=CC(C)C2CC3OC(O)CC4C(C)C(OC)C(OC(C)=O)C(C2(C)C1=O)C34C |
|
AD04399 | 1.87 | 362.26 | C4H13O7P3S3 | COP(O)(=S)OCP(=O)(O)COP(=S)(S)OC |
|
AD04400 | -1.43 | 1031.87 | C33H44O19N7P3S3 | COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1C2CC1(COP(O)(=S)OC1C3OCC1(CO)OC3n1cc(C)c(N)nc1=O)OC2n1cc(C)c(=O)[nH]c1=O |