aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04381 | 1.05 | 131.24 | C6H13NS | CSC1CCN(C)C1 |
|
AD04382 | 1.57 | 98.12 | C2H4F2S | CSC(F)F |
|
AD04383 | 3.41 | 422.24 | C21H14O3N3FCl2 | OCC(O)C(O)c1nn(-c2ccc(F)cc2)c2nc3cc(Cl)c(Cl)cc3cc12 |
|
AD04384 | -0.71 | 75.07 | C2H5O2N | CONC=O |
|
AD04385 | 1.85 | 246.78 | C13H23ON2Cl | CCC1CCN(C)C(C(=O)NCC(C)Cl)C1 |
|
AD04386 | 3.93 | 280.33 | C17H16O2N2 | CC(=O)C=Cc1ccc(NC(=O)Nc2ccccc2)cc1 |
|
AD04387 | 1.51 | 232.16 | C9H7O2N2F3 | NC(=O)NC(=O)c1ccc(C(F)(F)F)cc1 |
|
AD04388 | 1.54 | 88.17 | C4H8S | C=CCSC |
|
AD04389 | 2.91 | 1257.17 | C62H69O16N10Cl2 | CC[N+](C)(C)CCCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c4ccc(c(Cl)c4)Oc4cc3cc(c4O)Oc3ccc(cc3Cl)C2O)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD04390 | 3.14 | 315.31 | C14H22O5NP | CCCCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1 |