aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11701 | 2.01 | 188.18 | C11H8O3 | O=c1cc(O)cc(-c2ccccc2)o1 |
|
AD11702 | 5.4 | 393.43 | C24H21O2NF2 | O=C1C(CCCc2ccc(F)cc2)C(c2ccc(O)cc2)N1c1ccc(F)cc1 |
|
AD11703 | 7.94 | 636.87 | C35H38ON7S2 | O=C(CCCCC1CCSS1)Nc1ccc(CCNc2nc3c(c(NCC(c4ccccc4)c4ccccc4)n2)N=C[N]3)cc1 |
|
AD11704 | 3.49 | 299.4 | C16H23N6 | C1=Nc2c(nc(NC3CCCCC3)nc2NC2CCCC2)[N]1 |
|
AD11705 | 0.92 | 243.25 | C11H11ON6 | Nc1nc(OCCc2cc[nH]c2)nc2c1N=C[N]2 |
|
AD11706 | 2.34 | 614.73 | C30H50O11N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=O)N3C)C(C)(O)CC(C)CNC(C)C2OC(=O)OC12C |
|
AD11707 | 1.26 | 1409.43 | C59H58O24N9P2Cl3 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)OCC(=O)NC(P(=O)(O)O)P(=O)(O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3cc(Cl)c(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD11708 | 0.19 | 620.83 | C31H60O10N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(N(C)C)C(C)C(O)C1(O)CO |
|
AD11709 | -0.43 | 125.11 | C4H5ON4 | COC(=N)C1=N[N]C=N1 |
|
AD11710 | 1.84 | 204.26 | C10H14N5 | CC(C)CCNc1ncnc2c1N=C[N]2 |