aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16171 | 1.22 | 557.42 | C20H30O3N8I | CN(CCCN(C)C(=O)CCCNc1ncnc2c1N=C[N]2)C(=O)CCCNC(=O)CI |
|
AD16172 | 0.52 | 561.71 | C28H51O10N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD16173 | 0.78 | 617.78 | C30H55O10N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(=N)N)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD16174 | 9.11 | 601.04 | C35H72O3N2S | CCCCCCCCCCCCCCCCNC(=S)NC(CO)C(O)C(O)CCCCCCCCCCCCCC |
|
AD16175 | 0.56 | 235.29 | C11H17ON5 | CCCCN(C)c1nc2c(c(=O)[nH]1)[N+](C)=C[N]2 |
|
AD16176 | 2.53 | 541.61 | C30H31O5N5 | NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccccc1)NC(=O)CCC(=O)Nc1ccc(O)cc1 |
|
AD16177 | 1.79 | 383.43 | C19H23O3N6 | O=C(CCCOc1ccccc1)NCCOCCNc1ncnc2c1N=C[N]2 |
|
AD16178 | 3.04 | 417.45 | C22H21O3N6 | O=C(NCCOCCNc1ncnc2c1N=C[N]2)c1ccc(Oc2ccccc2)cc1 |
|
AD16179 | 1.84 | 415.44 | C21H19O2N8 | NNC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1 |
|
AD16180 | -3.3 | 368.39 | C16H24O6N4 | CNC(=O)C1CCCN1C(=O)C1(C)NC(C(O)CO)C2C(=O)NC(=O)C21 |