aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01981 | 2.0 | 122.17 | C8H10O | COc1ccc(C)cc1 |
|
AD01982 | 0.9 | 237.04 | C7H3N5Br | N#CC1=C(Br)[N]c2ncnc(N)c21 |
|
AD01983 | -1.02 | 424.46 | C17H28O5N8 | CC(C)(C)OC(=O)NCC(=O)NC(CCCNC(=N)N)C(=O)Nc1cc[nH]c(=O)n1 |
|
AD01984 | 6.27 | 458.68 | C29H46O4 | CCC(C(=O)CC(C)C1=C(O)C(=O)C2C3CCC4CC(O)CCC4(C)C3CCC12C)C(C)C |
|
AD01985 | -0.65 | 944.2 | C44H77O8N15 | CCCN(CC(=O)N(CCC)CC(=O)N(CCC)CC(=O)N(CCC)CC(=O)N(CCCn1cc(CCCC(=O)NC)nn1)CC(N)=O)C(=O)CNCCCn1cc(CCCC(=O)NC)nn1 |
|
AD01986 | 0.65 | 187.61 | C8H8O2N2Cl | CCOC(=O)C1=CC(CCl)=N[N]1 |
|
AD01987 | 1.93 | 452.5 | C23H32O9 | C=CC(C)(O)CCC=C(C)C(=O)OC1CC(C)(OC(C)=O)C2C(O)OC=C(C(=O)OC)C12 |
|
AD01988 | -2.9 | 289.33 | C12H23O5N3 | NC1CC=C(CO)OC1OC1C(N)CC(N)C(O)C1O |
|
AD01989 | -2.67 | 302.38 | C13H26O4N4 | CNCC1=CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1 |
|
AD01990 | 3.99 | 624.58 | C31H33O10N2P | Cc1cn(C2CC(OP(=O)(O)O)C(COCc3ccc(OCc4ccccc4)c(OCc4ccccc4)c3)O2)c(=O)[nH]c1=O |