aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19671 | -0.88 | 210.25 | C6H14O4N2S | CCCC(N)C(=O)NS(=O)(=O)OC |
|
AD19672 | 0.92 | 202.11 | C7H3ON3F3 | O=c1[nH]cnc2c1C(C(F)(F)F)=C[N]2 |
|
AD19673 | 5.23 | 1297.13 | C66H59O17N9Cl2 | CNC1C(=O)NC2Cc3ccc(cc3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(cc(O)c2Cl)Oc2ccc1cc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)NCCCN(C)C)NC3=O |
|
AD19674 | 3.31 | 229.12 | C8H5NF6 | Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
|
AD19675 | -5.29 | 536.58 | C22H40O11N4 | NC1CC(N)C2OCCCCC(=O)NCC3OC(OC4C(CO)OC(OC2C1O)C4O)C(N)C(O)C3O |
|
AD19676 | 0.98 | 144.2 | C5H8ON2S | CSCc1cc(O)[nH]n1 |
|
AD19677 | 2.75 | 256.33 | C14H18N5 | CCCCC#Cc1nc2c(c(NC(C)C)n1)N=C[N]2 |
|
AD19678 | 4.5 | 288.77 | C18H17O2Cl | C=CCOc1ccc(Cc2ccc(OC)cc2)c(Cl)c1 |
|
AD19679 | 4.65 | 302.8 | C19H19O2Cl | CCc1ccc(Cc2ccc3c(c2Cl)OCCCO3)cc1 |
|
AD19680 | 5.12 | 316.85 | C19H17OClS | Clc1c(Cc2ccc(SC3CC3)cc2)ccc2c1OCC2 |