aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14161 | 3.16 | 337.33 | C19H15O5N | Cc1c(O)ccc2c(O)c(NC(=O)C=Cc3ccccc3)c(=O)oc12 |
|
AD14162 | 2.48 | 357.32 | C18H15O7N | COc1cc(C(=O)Nc2c(O)c3ccc(O)c(C)c3oc2=O)ccc1O |
|
AD14163 | 2.31 | 237.29 | C14H13N4 | Cc1ccc(C2=C[N]c3ncnc(N)c32)cc1C |
|
AD14164 | 3.6 | 299.31 | C18H11ON4 | Nc1ncnc2c1C(c1cccc3c1oc1ccccc13)=C[N]2 |
|
AD14165 | 3.55 | 308.38 | C19H20O2N2 | CCc1cc(O)c2c(CCc3ccc4c(c3)CCO4)n[nH]c2c1 |
|
AD14166 | -1.9 | 784.47 | C22H31O16N10P3 | Cn1c(N)nc2c(ncn2C2CC(OP(=O)(O)O)C(COP(=O)(O)OC3CC(n4cnc5c(=O)n(C)c(N)nc54)OC3COP(=O)(O)O)O2)c1=O |
|
AD14167 | 0.38 | 210.22 | C12H8ON3 | NC(=O)C1=N[N]C=C1C#Cc1ccccc1 |
|
AD14168 | 9.59 | 1006.58 | C54H95O6N5S3 | CC(C)CCCC(C)C1CCC2C3CC=C4CC(OCCCCCCNC(=O)C(CCCCNC(=O)CCS)NC(=O)C(CCCCNC(=O)CCS)NC(=O)CCS)CCC4(C)C3CCC12C |
|
AD14169 | 6.12 | 648.62 | C36H28O10N2 | COc1cc(C(=O)Nc2cc3ccc(O)c(C)c3oc2=O)cc(-c2cc(OC)cc(C(=O)Nc3cc4ccc(O)c(C)c4oc3=O)c2)c1 |
|
AD14170 | -1.93 | 2159.42 | C68H89O42N26P7 | COP(=O)(O)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(O)OC1CC(n2ccc(N)nc2=O)OC1COP(=O)(O)OC1CC(n2ccc(N)nc2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2ccc(N)nc2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO |