aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21751 | 2.23 | 273.71 | C13H10N6Cl | Nc1nc(NCc2ccccc2Cl)nc2c1N=C[N]2 |
|
AD21752 | 5.02 | 576.83 | C35H52O3N4 | COc1ccc(Cc2ccc(C=CC(C)(C)C(=O)NC(C)(C)C(=O)NCCN3CCN(C)CC3)cc2C)c(C(C)C)c1 |
|
AD21753 | 1.41 | 210.23 | C11H14O4 | COc1cc(O)c(OC)c(C=CCO)c1 |
|
AD21754 | 0.56 | 1168.32 | C60H73O12N13 | CC(C)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CC(=O)O)NC(=O)C(N)CO)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CCCCN)C(N)=O |
|
AD21755 | 3.78 | 449.47 | C27H19O4N3 | O=C(NCC#Cc1ccc2c(c1)C(=C1C(=O)Nc3ccccc31)C(=O)N2)OCc1ccccc1 |
|
AD21756 | -2.69 | 401.35 | C14H28O10NP | COP(=O)(O)CCC1(CO)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O1 |
|
AD21757 | 3.0 | 315.31 | C14H22O5NP | CCOC(=O)C(NP(=O)(OC)Oc1ccccc1)C(C)C |
|
AD21758 | -11.77 | 3019.42 | C132H216O46N32S | 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)NC)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 |
|
AD21759 | 3.21 | 336.47 | C20H32O4 | CC12CCC(O)CC1CCC1C2CCC2(C)C(C(=O)O)CCC12O |
|
AD21760 | 2.53 | 541.61 | C30H31O5N5 | NC(=O)C(Cc1ccccc1)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)Nc1ccc(O)cc1 |