aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12541 | 1.21 | 276.81 | C14H25O2N2Cl | CCCCC1CN(CCO)C1C(=O)NCC(C)Cl |
|
AD12542 | 4.13 | 484.64 | C28H40O5N2 | COC12C=CC(C)(O1)C(OC(=O)CCc1cn(C)cn1)CC1C(C)=CCC(C(C)C)C1C=C2CO |
|
AD12543 | -4.0 | 1007.12 | C50H62O11N12 | CC(c1ccccc1)C1NC(=O)CNC(=O)C(COC(=O)C(c2ccccc2)c2ccccc2)NC(=O)C(C(O)C2CNC(N)N2)NC(=O)C(C(O)C2CNC(N)N2)NC(=O)C(Cc2ccc(O)cc2)NC1=O |
|
AD12544 | 3.58 | 292.33 | C12H15ON2F3S | CSCCCNC(=O)Nc1ccc(C(F)(F)F)cc1 |
|
AD12545 | 0.79 | 194.21 | C8H6O2N2S | O=c1[nH]cc(-c2cccs2)c(=O)[nH]1 |
|
AD12546 | 3.08 | 252.3 | C14H14N5 | CCCc1ccccc1Nc1ncnc2c1N=C[N]2 |
|
AD12547 | 0.38 | 222.23 | C9H12O2N5 | COCCCOc1nc(N)nc2c1N=C[N]2 |
|
AD12548 | 1.33 | 165.24 | C10H15ON | CNC(CCO)c1ccccc1 |
|
AD12549 | -1.36 | 150.12 | C5H4ON5 | NC1=N[N]c2nc[nH]c(=O)c21 |
|
AD12550 | 4.13 | 320.43 | C19H28O4 | COc1ccc(C(=O)OCCCCCCCCC=CCO)cc1 |