aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23471 | 7.08 | 872.11 | C44H55O7N8S2 | CC[N+]1=C(C=CC=CC=C2N(CCCCCC(=O)NCCCCCCNc3ncnc4c3N=C[N]4)c3ccc(S(=O)(=O)O)cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21 |
|
AD23472 | 4.57 | 519.82 | C31H57O3N3 | COC1CC2CC(O)CCC2(C)C2CCC3(C)C(C(C)CCC(=O)N(CCCN)CCCN)CCC3C12 |
|
AD23473 | 3.55 | 262.38 | C14H18ON2S | CSc1ccc(Cc2c(O)n[nH]c2C(C)C)cc1 |
|
AD23474 | 2.58 | 260.26 | C15H13O3F | O=C(Oc1ccc(CCO)cc1)c1cccc(F)c1 |
|
AD23475 | 0.33 | 364.39 | C19H24O7 | CC(CO)C1OC(=O)C=C2C3(C)CCC(O)C4(C)C(=O)OC(C34)C3OC213 |
|
AD23476 | 2.45 | 272.3 | C16H16O4 | COc1ccc(C(=O)Oc2ccc(CCO)cc2)cc1 |
|
AD23477 | 3.21 | 280.34 | C14H10N5S | C1=Nc2c(ncnc2NCc2csc3ccccc23)[N]1 |
|
AD23478 | 0.61 | 204.06 | C3H10O6P2 | COP(=O)(CP(=O)(O)O)OC |
|
AD23479 | 4.05 | 304.39 | C17H24O3N2 | COc1cc(-c2nc(C(C)C)c(C(C)C)[nH]2)cc(OC)c1O |
|
AD23480 | 2.85 | 256.31 | C12H10N5S | CSc1ccc(Nc2ncnc3c2N=C[N]3)cc1 |