aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18621 | 3.61 | 208.3 | C13H20O2 | CCCCCCCc1cc(O)cc(O)c1 |
|
AD18622 | 2.69 | 291.41 | C13H25O4NS | CCCCCCCCCC=CC(=O)NS(=O)(=O)OC |
|
AD18623 | -1.31 | 2244.23 | C109H129O29N21Cl2 | CC(C)CC1NC(=O)CNC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)C)NC(=O)C(CCCN)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CNC(=O)C(CC(N)=O)NC(=O)c2ccc(Cl)cc2)C(C(N)=O)OC(=O)C(c2ccc(O)c(Cl)c2)NC(=O)C(C)NC1=O |
|
AD18624 | 2.66 | 283.33 | C16H17O2N3 | COCc1cn(CCOc2cccc3ccccc23)nn1 |
|
AD18625 | 2.0 | 269.3 | C15H15O2N3 | OCc1cn(CCOc2cccc3ccccc23)nn1 |
|
AD18626 | 8.48 | 553.84 | C36H51N5 | CCN(C1CC(CCc2nc3cc(C(C)(C)C)ccc3[nH]2)C1)C1CC(CCc2nc3cc(C(C)(C)C)ccc3[nH]2)C1 |
|
AD18627 | 4.13 | 380.75 | C19H12O2N2F3Cl | O=C(NCc1ccc(Cl)cc1)c1c[nH]c2ccc(C(F)(F)F)cc2c1=O |
|
AD18628 | 4.53 | 300.36 | C20H16ON2 | Oc1cccc2[nH]cc(Cc3ccc(-c4cccnc4)cc3)c12 |
|
AD18629 | 1.21 | 916.09 | C44H69O12N9 | COCCOc1nc(N)c2[nH]c(=O)n(Cc3ccc(C(=O)NCCCCCC(=O)N(CCCO)CCC(=O)N(CCCO)CCC(=O)N(CCCO)CCC(=O)OC(C)(C)C)cc3)c2n1 |
|
AD18630 | 0.76 | 206.2 | C10H10O3N2 | Cn1c(CO)nc2ccc(C(=O)O)cc21 |