aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21211 | 1.83 | 289.38 | C16H23O2N3 | CN(CCCc1c[nH]c2ccccc12)CCC(N)C(=O)O |
|
AD21212 | 3.82 | 342.4 | C15H23O3N2PS | COP(=O)(NCCc1c[nH]c2ccccc12)OCCCSC |
|
AD21213 | 2.82 | 278.47 | C16H26N2S | CSCCCCCNCC1Cc2ccccc2CN1 |
|
AD21214 | 2.0 | 295.75 | C13H10O2N3ClS | CC(=NNC(N)=S)c1cc2cc(Cl)ccc2oc1=O |
|
AD21215 | 1.26 | 306.3 | C12H10O4N4S | CC(=NNC(N)=S)c1cc2cc([N+](=O)[O-])ccc2oc1=O |
|
AD21216 | 1.17 | 99.18 | C6H13N | CC=C(C)CNC |
|
AD21217 | 4.17 | 325.8 | C20H16O2NCl | CC(=O)C=C1C(=O)N(Cc2cccc(C)c2)c2ccc(Cl)cc21 |
|
AD21218 | 1.89 | 246.29 | C12H16ON5 | COCc1nc2c(c(NC3CCCC3)n1)N=C[N]2 |
|
AD21219 | 2.39 | 368.43 | C21H24O4N2 | C=CC1CN2CCC3(C(=O)Nc4ccccc43)C2CC1C(=COC)C(=O)O |
|
AD21220 | 0.86 | 265.24 | C13H12O4NF | CNC(=O)COC1=C(c2ccc(F)cc2)C(=O)OC1 |