aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03441 | 0.54 | 345.44 | C16H31O5N3 | CC(NC(=O)OC(C)(C)C)C(=O)NC(C(=O)NCCCO)C(C)C |
|
AD03442 | 0.06 | 437.5 | C20H31O6N5 | COCCC(=O)NC(CCCCN)C(=O)NNC(=O)c1cc(NC(C)=O)ccc1OC |
|
AD03443 | 4.51 | 596.67 | C30H27O2N9FS | O=C(Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1)NCCN=C(S)Nc1ccc(F)cc1 |
|
AD03444 | 2.01 | 303.25 | C12H18O6NP | CCCOc1cccc(C(OC(=O)NC)P(=O)(O)O)c1 |
|
AD03445 | 2.76 | 311.29 | C17H13O5N | Cc1c(O)ccc2c(O)c(NC(=O)c3ccccc3)c(=O)oc12 |
|
AD03446 | 0.42 | 126.11 | C5H6O2N2 | Cc1nc[nH]c1C(=O)O |
|
AD03447 | 0.25 | 972.18 | C45H74O8N15F | N=C(N)NCC1OC(OC2C(NC(=N)N)CC(NC(=N)N)C(O)C2OCCCCCCCCCCCCN2CCN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)CC2)C(NC(=N)N)CC1O |
|
AD03448 | 5.4 | 572.81 | C34H54O6N | CCC1CCCC(OC(=O)CCC[N+](CC)(CC)CC)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1 |
|
AD03449 | 7.52 | 733.91 | C46H54O6P | CCC1CCCC(OC(=O)CCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1 |
|
AD03450 | 7.38 | 1006.34 | C58H90O10N2P | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(C(=O)CCCCCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(C)C(O)C1(C)O |