aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06031 | 3.67 | 246.74 | C15H15N2Cl | CCCc1ccc(Cc2ccccc2Cl)nn1 |
|
AD06032 | 4.46 | 295.77 | C18H14N3Cl | Clc1ccccc1Cc1ccc(Nc2ccccc2)nn1 |
|
AD06033 | 1.23 | 278.3 | C15H12ON5 | CC(O)(C#Cc1nc(N)c2c(n1)[N]C=N2)c1ccccc1 |
|
AD06034 | 6.0 | 560.7 | C34H36O2N6 | C=CC1=C(C)c2cc3nc(cc4[nH]c(cc5[nH]c(cc1n2)c(C)c5CCC(N)=O)c(CCC(N)=O)c4C)C(C=C)=C3C |
|
AD06035 | -1.23 | 150.14 | C6H6ON4 | NC1=NC(=O)C2NC=CC2=N1 |
|
AD06036 | 1.49 | 435.45 | C21H26O6N3F | O=C(CCCO)NCCOCCNc1cc2c(cc1F)c(=O)c(C(=O)O)cn2C1CC1 |
|
AD06037 | 2.62 | 307.67 | C12H15O5NPCl | COC(=O)C(C)NP(=O)(OC)Oc1ccc(Cl)cc1 |
|
AD06038 | 3.42 | 190.27 | C11H10OS | COc1ccc(-c2cccs2)cc1 |
|
AD06039 | -1.25 | 316.4 | C14H28O4N4 | CC(N)C(=O)NC(CCC(N)=O)C(=O)NCCCCCCO |
|
AD06040 | 1.99 | 302.24 | C15H10O7 | O=c1c(O)c(-c2cccc(O)c2O)oc2cc(O)cc(O)c12 |