aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30911 | -0.89 | 212.2 | C9H12O4N2 | COc1cc[nH]c(=O)c1C(=O)NCCO |
|
AD30912 | 1.51 | 204.15 | C8H7ON2F3 | Cc1nccc(C(F)(F)F)c1C(N)=O |
|
AD30913 | -0.22 | 193.62 | C5H4O2N3ClS | NS(=O)(=O)c1cnc(Cl)nc1 |
|
AD30914 | 0.02 | 207.28 | C6H9O3NS2 | O=S(=O)(NCCO)c1ccsc1 |
|
AD30915 | 0.66 | 193.18 | C9H8ON3F | NC(=O)Cn1cnc2ccc(F)cc21 |
|
AD30916 | 0.51 | 196.21 | C9H12O3N2 | COc1nc(OC)c(C(N)=O)cc1C |
|
AD30917 | 1.23 | 200.62 | C9H9O2N2Cl | CCOc1cc(C(N)=O)c(Cl)cn1 |
|
AD30918 | 1.3 | 205.67 | C8H8O2NClS | Cc1cc(S(N)(=O)=O)ccc1Cl |
|
AD30919 | 0.06 | 205.22 | C10H11O2N3 | O=C(NCCO)c1cccn2ccnc12 |
|
AD30920 | -0.05 | 214.2 | C9H11O3N2F | COc1nccc(F)c1C(=O)NCCO |