aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17201 | 5.3 | 360.11 | C9H5F13 | CC=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
|
AD17202 | 6.51 | 910.94 | C35H56O14N6P2S2 | COP(=O)(O)OCCSc1ccc(NC(=O)NCCCCCCNC(=O)OCOC(=O)NCCCCCCNC(=O)NSc2ccc(CCOP(=O)(O)OC)cc2)cc1 |
|
AD17203 | 1.02 | 172.21 | C7H8O3S | COS(=O)(=O)c1ccccc1 |
|
AD17204 | 2.28 | 286.24 | C15H10O6 | O=c1oc2cc(O)ccc2c(O)c1-c1ccc(O)cc1O |
|
AD17205 | 3.99 | 859.18 | C46H74O9N4S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)NC(c2ccccc2)c2ccccc2)C(C)C(O)C1(C)O |
|
AD17206 | 3.77 | 237.3 | C16H15ON | Cc1ccc(Cc2c[nH]c3cccc(O)c23)cc1 |
|
AD17207 | 2.72 | 825.05 | C42H72O12N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccc3c(c2)OCCCO3)C(C)C(O)C1(C)O |
|
AD17208 | 4.14 | 859.12 | C46H74O11N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccc(OCc3ccccc3)cc2)C(C)C(O)C1(C)O |
|
AD17209 | 4.78 | 254.93 | C12H3NCl4 | Clc1cc2[nH]c(Cl)c(Cl)c2cc1Cl |
|
AD17210 | 5.76 | 2522.15 | C124H114O34N20Cl4 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NCc4c5oc6c(CNC(=O)C7NC(=O)C8NC(=O)C(NC(=O)C9NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c%10ccc(c(Cl)c%10)Oc%10cc9cc(c%10O)Oc9ccc(cc9Cl)C8O)c8ccc(O)c(c8)-c8c(O)cc(O)cc87)cccc6nc-5cc(N)c4=O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |