aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14481 | -0.11 | 149.16 | C6H7N5 | Nc1nc(N)c2cccn2n1 |
|
AD14482 | -2.84 | 434.44 | C17H24O5N9 | CC(NC(=O)CO)C(=O)NC(CCC(=O)NCCNc1ncnc2c1N=C[N]2)C(N)=O |
|
AD14483 | 3.28 | 588.74 | C30H52O11 | CCCCCC1CCCCCCCCCC(=O)OC2C(OC(C)C(O)C2O)OC2C(O1)OC(C)C(OC(C)=O)C2O |
|
AD14484 | 3.24 | 1327.16 | C66H61O17N11Cl2 | NCCN(CCN)CCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD14485 | 5.25 | 416.65 | C27H44O3 | CC(C)=CCC(O)C(C)C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3CCC21C |
|
AD14486 | 3.28 | 367.2 | C12H8N4SI | Ic1cccc(SCc2ncnc3c2N=C[N]3)c1 |
|
AD14487 | 3.99 | 310.19 | C14H7N4Cl2S | Clc1ccc(SCc2ncnc3c2N=C[N]3)cc1Cl |
|
AD14488 | -1.08 | 548.55 | C26H32O11N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNCc2ccc(-c3ccc(C(=O)O)cc3)cc2)O1 |
|
AD14489 | 0.08 | 195.15 | C6H14O4NP | CCC(=O)NCC(C)P(=O)(O)O |
|
AD14490 | 2.38 | 559.6 | C29H30O4N7F | O=CNCc1cn(Cc2ccc(CN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C4CC4)CC3)cc2)nn1 |