aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06191 | 4.47 | 907.16 | C49H74O10N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(Cc2ccc(-c3cn(CCn4ccc5cc(OC)ccc54)nn3)cc2)C(C)C(O)C1(C)O |
|
AD06192 | 0.61 | 131.22 | C7H17ON | CNC(CO)CC(C)C |
|
AD06193 | 4.59 | 434.66 | C27H46O4 | CC(CO)CCC(=O)C(C)C1CC(O)C2C3CCC4CC(O)CCC4(C)C3CCC12C |
|
AD06194 | 4.58 | 1269.07 | C64H55O17N9Cl2 | CN(C)CCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD06195 | 4.35 | 1311.11 | C66H57O18N9Cl2 | NC1C(=O)NC2Cc3ccc(c(Cl)c3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(O)cc(c2)Oc2cc1ccc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)NCCN1CCOCC1)NC3=O |
|
AD06196 | 1.88 | 168.27 | C8H12N2S | Cc1nc(C2CCCN2)cs1 |
|
AD06197 | 1.61 | 240.32 | C12H16O3S | OC1CC(S)COC1OCc1ccccc1 |
|
AD06198 | 2.26 | 278.14 | C10H3O2N2F5 | O=c1nc(Oc2c(F)c(F)c(F)c(F)c2F)cc[nH]1 |
|
AD06199 | 4.88 | 676.75 | C27H54O11N2P2S | CCCCCCCCCCCCCC(=O)CSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD06200 | 5.47 | 476.74 | C30H52O4 | C=C(CCCC(C)(C)O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C |