aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18991 | 1.5 | 364.39 | C19H24O7 | COc1cc(C(O)C(CO)Oc2ccc(CCCO)cc2O)ccc1O |
|
AD18992 | 5.59 | 381.88 | C24H21ONFCl | Fc1ccc(N2CC(COc3ccc(Cc4ccccc4Cl)cc3)C2)cc1 |
|
AD18993 | 4.18 | 486.69 | C30H46O5 | CC1(C)CCC2(CO)C(=O)C(O)C3(C)C(=C2C1)C=CC1C2(C)CCC(O)C(C)(CO)C2CCC13C |
|
AD18994 | 3.94 | 356.48 | C18H22ON5S | CCCCSc1nc2c(c(NCCc3cccc(OC)c3)n1)N=C[N]2 |
|
AD18995 | 4.27 | 306.46 | C15H24N5S | CCCCCCNc1nc(SCCCC)nc2c1N=C[N]2 |
|
AD18996 | 4.33 | 360.47 | C20H18N5S | C1=Nc2c(nc(SCc3ccccc3)nc2NCCc2ccccc2)[N]1 |
|
AD18997 | 6.54 | 1359.11 | C69H53O19N9Cl2 | O=C1NC2C(=O)NC3c4cc(c(O)c(c4)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC3O)c3ccc(O)c(c3)-c3c(O)cc(O)cc3C(C(=O)O)NC4=O)Oc3ccc(cc3Cl)CC1NC(=O)C(n1cc(COc3ccccc3)nn1)c1ccc(O)c(c1)Oc1cc(O)cc2c1 |
|
AD18998 | 7.3 | 1910.75 | C91H86O30N10Cl2S2 | CC1(C)OC2OC(CSC3=C(SCC4OC5OC(C)(C)OC5C5OC(C)(C)OC45)C(=O)N(Cc4cn(C5C(=O)NC6Cc7ccc(c(Cl)c7)Oc7cc8cc(c7O)Oc7ccc(cc7Cl)C(O)C7NC(=O)C(NC(O)C8NC(=O)C(NC6=O)c6cc(O)cc(c6)Oc6cc5ccc6O)c5ccc(O)c(c5)-c5c(O)cc(O)cc5C(C(=O)O)NC7=O)nn4)C3=O)C3OC(C)(C)OC3C2O1 |
|
AD18999 | 4.22 | 381.52 | C24H31O3N | Cc1cc(O)ccc1Cc1ccc(C=CC(C)(C)C(=O)NC(C)(C)CO)cc1 |
|
AD19000 | 7.05 | 1367.18 | C69H61O19N9Cl2 | CCCCCCOCc1cn(C2C(=O)NC3Cc4ccc(c(Cl)c4)Oc4cc5cc(c4O)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC(O)C5NC(=O)C(NC3=O)c3cc(O)cc(c3)Oc3cc2ccc3O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC4=O)nn1 |