aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40281 | 0.64 | 98.14 | C6H10O | C#CC(O)C(C)C |
|
AD40282 | -0.12 | 98.1 | C5H6O2 | O=C1C=CC(O)C1 |
|
AD40283 | 0.69 | 106.19 | C4H10OS | CC(O)C(C)S |
|
AD40284 | -0.29 | 116.12 | C5H8O3 | C=CC(O)C(=O)OC |
|
AD40285 | 2.26 | 201.25 | C10H7N3S | N#Cc1ccc(-c2cccs2)nc1N |
|
AD40286 | 1.6 | 196.21 | C11H8N4 | N#Cc1ccc(-c2ccncc2)nc1N |
|
AD40287 | 1.84 | 188.02 | C8H3N3Cl2 | N#Cc1nc(N)c(Cl)cc1Cl |
|
AD40288 | 2.15 | 201.27 | C12H15N3 | CC1(C)CCCc2cc(C#N)c(N)nc21 |
|
AD40289 | 0.57 | 301.39 | C12H21O3N4S | CCCCCCCCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1 |
|
AD40290 | 1.89 | 312.76 | C12H11O2N5ClS | C=CCC1(S(=O)(=O)Nc2nc(Cl)nc3c2N=C[N]3)CC1 |