aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20511 | 2.64 | 352.39 | C20H20O4N2 | C=CC1C(O)OC=C(C(=O)O)C1CC1=NCCc2c1[nH]c1ccccc21 |
|
AD20512 | -1.14 | 600.65 | C28H37O6N8F | NC1CC(NCc2cn(CCN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C4CC4)CC3)nn2)C(O)C(O)C1O |
|
AD20513 | 0.52 | 190.23 | C10H12ON3 | CCCCC#CC1=C(C(N)=O)N=C[N]1 |
|
AD20514 | 3.36 | 274.3 | C13H23O4P | COP(=O)(O)OCCC12CC3CC(CC(C3)C1)C2 |
|
AD20515 | 3.11 | 368.3 | C19H12O8 | COc1cc2cc(Oc3cc(O)c4ccc(=O)oc4c3)c(=O)oc2cc1O |
|
AD20516 | 5.34 | 423.6 | C27H37O3N | Cc1cc(C=CC(C)(C)C(=O)NC(C)(C)CO)ccc1Cc1ccc(O)cc1C(C)C |
|
AD20517 | 1.98 | 210.24 | C12H10N4 | Nc1ncnn2ccc(-c3ccccc3)c12 |
|
AD20518 | 2.21 | 328.34 | C18H17O3N2F | CC(=O)NCCc1ccc(O)c2c1c1cccc(F)c1c(=O)n2C |
|
AD20519 | 2.12 | 244.33 | C12H24O3N2 | CCCCCNC(=O)CCCCCNC(=O)O |
|
AD20520 | 2.85 | 478.58 | C26H38O8 | C=C1C(O)CC(OC(C)=O)C2(C)C1CC1CC(O)C(C)=C(C(OC(C)=O)C2OC(C)=O)C1(C)C |