aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21781 | 2.06 | 322.36 | C19H18O3N2 | NC(Cc1cc2ccccc2c2ccccc12)C(=O)NCC(=O)O |
|
AD21782 | -3.84 | 264.26 | C8H12O6N2S | O=C1NC(=S)NC12OC(CO)C(O)C(O)C2O |
|
AD21783 | -4.25 | 706.81 | C30H50O8N12 | CC(O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(CCCNC(=N)N)NC(=O)C(N)CCC(N)=O)C(=O)NC(CCCNC(=N)N)C(=O)O |
|
AD21784 | 1.21 | 198.15 | C9H7O4F | O=C(O)CC(=O)Oc1ccc(F)cc1 |
|
AD21785 | 14.71 | 1681.78 | C88H95O20N7Cl2S2 | CCCCCCCCCCCCSC1=C(SCCCCCCCCCCCC)C(=O)N(C2C(=O)NC3Cc4ccc(c(Cl)c4)Oc4cc5cc(c4O)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC(O)C5NC(=O)C(NC3=O)c3cc(O)cc(c3)Oc3cc2ccc3O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC4=O)C1=O |
|
AD21786 | -0.45 | 271.12 | C7H13O7P2 | COP(=O)([O-])OC(C1CCCC1)P(=O)([O-])[O-] |
|
AD21787 | 1.68 | 232.27 | C11H14ON5 | Nc1nc(OC2CCCCC2)nc2c1N=C[N]2 |
|
AD21788 | 2.04 | 120.15 | C8H8O | C=Cc1ccc(O)cc1 |
|
AD21789 | 0.23 | 200.28 | C10H20O2N2 | CCC(=O)NCCCN1CCOCC1 |
|
AD21790 | 0.89 | 152.54 | C4H5O3N2Cl | O=NN(CCCl)C(=O)O |