aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21351 | 9.74 | 568.84 | C36H56O5 | CCCCC1CCCCC(C)Cc2cc(O)c(c(O)c2)C(CCCC)CCCCC(C)C(O)c2cc(O)c1c(O)c2 |
|
AD21352 | 1.15 | 356.15 | C11H11ON5I | O=C(CNc1ncnc2c1C(I)=C[N]2)NC1CC1 |
|
AD21353 | 2.14 | 253.29 | C13H13N6 | CC(Nc1nc(N)c2c(n1)[N]C=N2)c1ccccc1 |
|
AD21354 | -30.05 | 4920.87 | C203H248O57N92S | Cc1cn(CC(=O)N(CCNC(=O)CCCCCO)CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NC(CCCCNC(=S)Nc2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)C(N)=O)C(=O)Cn2cc(C)c(=O)[nH]c2=O)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2cc(C)c(=O)[nH]c2=O)C(=O)Cn2cnc3c(N)ncnc32)C(=O)Cn2cnc3c(=O)[nH]c(N)nc32)C(=O)Cn2cnc3c(N)ncnc32)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2cc(C)c(=O)[nH]c2=O)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2cnc3c(=O)[nH]c(N)nc32)C(=O)Cn2cnc3c(=O)[nH]c(N)nc32)C(=O)Cn2cnc3c(N)ncnc32)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2ccc(N)nc2=O)C(=O)Cn2ccc(N)nc2=O)c(=O)[nH]c1=O |
|
AD21355 | 2.3 | 724.94 | C37H64O10N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(C)C(C)C(OC(=O)NCc2ccncc2)C1(C)O |
|
AD21356 | 2.29 | 161.13 | C7H6NF3 | Nc1cccc(C(F)(F)F)c1 |
|
AD21357 | 1.39 | 289.37 | C10H16ON3PS2 | CCCOP(=S)(NNC(N)=S)c1ccccc1 |
|
AD21358 | 0.96 | 220.26 | C10H14ON5 | OCCCCCNc1ncnc2c1N=C[N]2 |
|
AD21359 | 1.09 | 193.2 | C10H11O3N | C=NC(Cc1ccc(O)cc1)C(=O)O |
|
AD21360 | 1.19 | 143.19 | C7H13O2N | C=NC(CC(C)C)C(=O)O |