aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36241 | 2.93 | 256.33 | C14H18N5 | C=CCC1(CNc2ncnc3c2N=C[N]3)CCCC1 |
|
AD36242 | 2.46 | 220.3 | C11H12ON2S | CC(C)(C#N)C(=O)Nc1ccc(S)cc1 |
|
AD36243 | 1.26 | 237.36 | C10H23O3NS | CCCCCCCCS(=O)(=O)NCCO |
|
AD36244 | 2.5 | 222.46 | C9H2N3Cl3 | N#Cc1c(Cl)nc(Cl)c(N)c1Cl |
|
AD36245 | 2.48 | 221.62 | C11H5N3FCl | N#Cc1c(Cl)nc2cccc(F)c2c1N |
|
AD36246 | 2.56 | 231.48 | C8H4N2ClBr | N#Cc1c(N)cc(Br)cc1Cl |
|
AD36247 | 0.95 | 245.35 | C15H21ON2 | N#CC1(c2ccccc2)CCC([NH2+]CCO)CC1 |
|
AD36248 | 3.91 | 267.36 | C15H13N3S | Cc1ccc(-c2n[nH]c(=S)n2-c2ccccc2)cc1 |
|
AD36249 | 3.13 | 246.35 | C16H22O2 | CC12CCC(O)C(C)(C)C1COc1ccccc12 |
|
AD36250 | 3.27 | 264.34 | C16H21O2F | CC12CCC(O)C(C)(C)C1COc1ccc(F)cc12 |