aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40201 | -0.62 | 294.42 | C16H28O2N3 | CN(CCC[NH+](C)C)Cc1ccc(C(=O)NCCO)cc1 |
|
AD40202 | -0.09 | 304.4 | C15H24ON6 | CC[NH+](CC)CCOC1CCN(c2ncnc3c2N=C[N]3)C1 |
|
AD40203 | -0.07 | 297.37 | C15H19N7 | C[NH+](C)CCN(Cc1ccccn1)c1ncnc2c1N=C[N]2 |
|
AD40204 | -1.98 | 180.19 | C8H10O2N3 | O=c1[nH]cc(C2=CC[NH2+]C2)c(=O)[nH]1 |
|
AD40205 | -1.5 | 234.26 | C10H14ON6 | OC1(CNc2ncnc3c2N=C[N]3)CC[NH2+]C1 |
|
AD40206 | -0.21 | 152.2 | C7H12N4 | C1=C(C2CCC[NH2+]C2)N=N[N]1 |
|
AD40207 | -0.6 | 138.17 | C6H10N4 | C1=C(C2CC[NH2+]C2)N=N[N]1 |
|
AD40208 | -0.21 | 152.2 | C7H12N4 | C1=C(C2CC[NH2+]CC2)N=N[N]1 |
|
AD40209 | -0.46 | 138.17 | C6H10N4 | C1=C(C2CCC[NH2+]2)N=N[N]1 |
|
AD40210 | -0.94 | 115.2 | C6H15N2 | CC1CC(N)CC[NH2+]1 |