aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33731 | -0.13 | 237.28 | C11H17O2N4 | COC(=O)C1CCN(c2cc[nH+]c(N)n2)CC1 |
|
AD33732 | 0.0 | 221.24 | C10H13O2N4 | CCOC(=O)Cn1ccc2c(N)[nH+]cnc21 |
|
AD33733 | 1.01 | 137.19 | C7H11N3 | CCCc1nccnc1N |
|
AD33734 | 1.01 | 137.19 | C7H11N3 | CCCc1ccc(N)nn1 |
|
AD33735 | 0.94 | 135.17 | C7H9N3 | Nc1ccnc(C2CC2)n1 |
|
AD33736 | 1.18 | 137.19 | C7H11N3 | CC(C)c1ccnc(N)n1 |
|
AD33737 | 0.94 | 135.17 | C7H9N3 | Nc1ccc(C2CC2)nn1 |
|
AD33738 | 0.55 | 135.17 | C7H9N3 | Nc1cc2c(nn1)CCC2 |
|
AD33739 | -0.16 | 271.07 | C8H7O2N4Br | O=C(CO)N=c1nc[nH]n2c(Br)ccc12 |
|
AD33740 | -0.12 | 137.14 | C6H7ON3 | Cc1ncc(C(N)=O)cn1 |