aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11521 | 0.81 | 148.17 | C7H8N4 | Cn1cnc(-c2ncc[nH]2)c1 |
|
AD11522 | 7.39 | 565.91 | C33H65O3N4 | CCCCCCCCCCCCCC(=O)NCC(NC(=O)CCCCCCCCCCCCC)C(=O)NCC[NH] |
|
AD11523 | 0.93 | 565.63 | C29H35O7N5 | CC(C)C(NC(=O)CO)C(=O)NC(CCC(=O)OCCCNC(=O)c1cccc2cc3ccccc3nc12)C(N)=O |
|
AD11524 | -1.27 | 348.36 | C16H20O5N4 | O=c1ccn(C2OC(C(O)CNCc3cccnc3)CC2O)c(=O)[nH]1 |
|
AD11525 | 2.59 | 273.36 | C14H21N6 | CCN(CC)c1nc2c(c(NC3CCCC3)n1)N=C[N]2 |
|
AD11526 | 1.17 | 307.34 | C16H15ON6 | O=C(CNc1ncnc2c1C(c1ccccc1)=N[N]2)NC1CC1 |
|
AD11527 | 4.51 | 550.72 | C33H44O6N | CCC1CCCC(OC(=O)CCC[n+]2ccccc2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1 |
|
AD11528 | 3.53 | 229.35 | C14H15NS | SN(Cc1ccccc1)Cc1ccccc1 |
|
AD11529 | 2.06 | 204.32 | C13H20N2 | Cc1cccc(N2CCN(C)CC2)c1C |
|
AD11530 | 1.51 | 148.21 | C9H12N2 | c1ccc(C2CCCN2)nc1 |