aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10761 | 2.25 | 218.35 | C12H10S2 | SCC#Cc1ccc(C#CCS)cc1 |
|
AD10762 | -2.67 | 150.12 | C4H4N7 | Nc1nc(N)c2c(n1)=N[N]N=2 |
|
AD10763 | 2.49 | 278.3 | C15H18O5 | CC1C2=C(O)C(=O)OC(c3ccoc3)C2(C)CCC1O |
|
AD10764 | 9.13 | 664.88 | C42H46ON7 | CC(C)(C)c1cc(C(=O)Nc2ccc(CCNc3nc4c(c(NCC(c5ccccc5)c5ccccc5)n3)N=C[N]4)cc2)cc(C(C)(C)C)c1 |
|
AD10765 | 0.33 | 169.55 | C6H2ON4Cl | O=c1[nH]c(Cl)nc2c1N=C[N]2 |
|
AD10766 | 3.82 | 325.07 | C10H11O4FPBr | COP1(=O)OCCC(c2cc(F)ccc2Br)O1 |
|
AD10767 | 6.68 | 828.14 | C45H81O12N | CCCCCCCC(=O)OC1C(OC2C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(OC(=O)CCCCCCC)C(C)C(=O)C(C)CC2(C)O)OC(C)CC1N(C)C |
|
AD10768 | -0.83 | 236.26 | C10H14O2N5 | OCCN(CCO)Cc1ncnc2c1N=C[N]2 |
|
AD10769 | 2.21 | 339.14 | C14H11O5Br | O=C1c2c(cc3cc(O)c(Br)c(O)c3c2O)CCC1O |
|
AD10770 | 5.38 | 1471.24 | C72H65O23N9Cl2 | COCCOCCOCCOCCOCc1cn(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)nn1 |