aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18851 | 0.45 | 229.22 | C10H9ON6 | C=CCN1C(=NC#N)[N]c2cc(N)nc(O)c21 |
|
AD18852 | 4.61 | 333.46 | C21H19ONS | CSCCNC(=O)Cc1ccc2ccc3cccc4ccc1c2c34 |
|
AD18853 | 5.21 | 695.77 | C39H41O9N3 | CC(=O)N(CC(=O)NC(CCC(=O)O)C(=O)O)C(CCc1ccc(Oc2ccc(Oc3ccccc3)cc2)cc1)C(=O)NCCc1ccccc1 |
|
AD18854 | 4.08 | 508.48 | C30H20O8 | CC1=CC(O)=C2C(=O)c3c(O)cccc3C(c3ccc4c(c3O)C(=O)c3c(O)cc(C)cc3C4O)=C2C1=O |
|
AD18855 | 3.05 | 321.24 | C13H8ON6F3 | O=C(Nc1cccc(C(F)(F)F)c1)Nc1ncnc2c1N=C[N]2 |
|
AD18856 | 4.01 | 248.33 | C17H16N2 | Cc1c2c(c(C)c3c1[nH]c1ccccc13)CNC=C2 |
|
AD18857 | 2.42 | 143.27 | C9H21N | CCCCC(CC)CNC |
|
AD18858 | -11.35 | 3020.41 | C132H215O47N31S | CCC(C)C(NC(=O)C(CO)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(CCC(N)=O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CO)NC(=O)C(NC(=O)C(CCC(=O)O)NC(=O)C(CC(=O)O)NC(=O)CCSC1CC(=O)N(CCCC(=O)NCCOCCOCCOCC(=O)OC)C1=O)C(C)C)C(=O)NC(C(=O)NC(CC(N)=O)C(=O)NC(Cc1ccccc1)C(=O)NC(CCC(=O)O)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(CCCCN)C(N)=O)C(C)CC |
|
AD18859 | 4.41 | 425.47 | C24H21O2N6 | COc1ccc(NC(=O)Nc2nc(C#CCCCc3ccccc3)nc3c2N=C[N]3)cc1 |
|
AD18860 | 4.3 | 270.76 | C17H15N2Cl | CCn1ncc2cc(Cc3ccccc3Cl)ccc21 |