aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31131 | -0.46 | 213.24 | C9H15O3N3 | CCOc1c(C(=O)NCCO)cnn1C |
|
AD31132 | -0.4 | 211.22 | C9H13O3N3 | CCOc1cc(C(=O)NCCO)cnn1 |
|
AD31133 | 0.28 | 204.03 | C5H6ON3Br | Cn1nc(C(N)=O)cc1Br |
|
AD31134 | -0.41 | 196.21 | C9H12O3N2 | COCCn1cccc(C(N)=O)c1=O |
|
AD31135 | -0.41 | 210.23 | C10H14O3N2 | CCn1cccc(C(=O)NCCO)c1=O |
|
AD31136 | 0.36 | 192.22 | C10H12O2N2 | NC(=O)c1cccn(CC2CC2)c1=O |
|
AD31137 | -0.75 | 213.24 | C9H15O3N3 | COCCn1cncc1C(=O)NCCO |
|
AD31138 | -0.75 | 213.24 | C9H15O3N3 | COCCn1cnc(C(=O)NCCO)c1 |
|
AD31139 | -0.26 | 188.21 | C6H8O3N2S | COc1ncccc1S(N)(=O)=O |
|
AD31140 | -0.42 | 200.22 | C7H8O3N2S | CS(=O)(=O)c1cc(C(N)=O)ccn1 |