aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22981 | 7.36 | 2086.96 | C99H102O34N10Cl2S2 | CC1(C)OC2OC(CSC3=C(SCC4OC5OC(C)(C)OC5C5OC(C)(C)OC45)C(=O)N(CCOCCOCCOCCOCc4cn(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 |
|
AD22982 | 2.35 | 255.41 | C14H29ON3 | CC(C)N(C)CCCNC(=O)NC1CCCCC1 |
|
AD22983 | 3.04 | 352.39 | C21H20O5 | CC1(C)c2ccccc2C(=O)c2c1oc1cc(OCC(O)CO)ccc21 |
|
AD22984 | 0.3 | 148.14 | C7H6ON3 | Cc1nc2c(c(=O)[nH]1)C=C[N]2 |
|
AD22985 | 2.72 | 288.71 | C15H11O2N3Cl | ClC1=C[N]c2ncnc(OCCOc3ccccc3)c21 |
|
AD22986 | 2.44 | 224.67 | C11H11ON3Cl | CCCCOc1ncnc2c1C(Cl)=C[N]2 |
|
AD22987 | 1.29 | 226.64 | C10H9O2N3Cl | COCCOc1ncnc2c1C(Cl)=C[N]2 |
|
AD22988 | 0.62 | 243.25 | C12H11O2N4 | O=C1C2C3C=CC(C3)C2C(=O)N1CC1=C[N]N=N1 |
|
AD22989 | 0.28 | 636.49 | C23H34O13N4P2 | COP(=O)(O)OP(=O)(O)NCCOCCOCCOCCC(=O)Nc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O |
|
AD22990 | -1.51 | 141.13 | C4H7ON5 | CNC(=O)Cc1nnn[nH]1 |