aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23521 | 1.07 | 240.25 | C12H10ON5 | COc1ccc(C2=N[N]c3ncnc(N)c32)cc1 |
|
AD23522 | -1.8 | 2607.32 | C126H204O27N28S2 | CCC(C)C(NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)C(CC(C)C)NC(=O)C(Cc1ccccc1)NC(=O)C1CSSCC(N)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1ccccc1)C(=O)O |
|
AD23523 | -0.15 | 363.45 | C15H21O2N7S | CSC1CCN(CCNC(=O)c2cnc3nc(N)[nH]c(=O)c3n2)CC1 |
|
AD23524 | 2.07 | 256.31 | C12H10N5S | Cc1cccc(SC2=N[N]c3ncnc(N)c32)c1 |
|
AD23525 | 3.7 | 188.29 | C12H12S | CSCc1ccc2ccccc2c1 |
|
AD23526 | 1.26 | 557.55 | C28H31O11N | CCC1(O)CC(OC2CC(N)C(O)C(C)O2)c2c(O)c3c(c(O)c2C1C(=O)OC)C(=O)c1cccc(O)c1C3=O |
|
AD23527 | 1.73 | 236.26 | C13H10N5 | Nc1ncnc2c1C(C=Cc1ccccc1)=N[N]2 |
|
AD23528 | 2.67 | 235.7 | C12H12N4Cl | Clc1cc(NC2CCCC2)c2c(n1)[N]N=C2 |
|
AD23529 | 7.9 | 1407.16 | C73H53O19N9Cl2 | O=C1NC2C(=O)NC3C(=O)NC4C(=O)NC(C(=O)NC(C(=O)O)c5cc(O)cc(O)c5-c5cc4ccc5O)C(O)c4ccc(c(Cl)c4)Oc4cc3cc(c4O)Oc3ccc(cc3Cl)CC1NC(=O)C(n1cc(COc3cccc4ccccc34)nn1)c1ccc(O)c(c1)Oc1cc(O)cc2c1 |
|
AD23530 | 0.28 | 133.13 | C6H5N4 | Nc1ncc2c(n1)[N]C=C2 |