aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31201 | -0.19 | 178.24 | C9H14N4 | c1n[nH]cc1CN1CC2(CNC2)C1 |
|
AD31202 | -0.02 | 183.3 | C10H21N3 | CN(C)CCN1CC2CCC(C1)N2 |
|
AD31203 | 0.33 | 195.22 | C9H13O2N3 | NC(=O)c1cnn(C2CCOCC2)c1 |
|
AD31204 | -0.05 | 214.2 | C9H11O3N2F | COc1ccnc(F)c1C(=O)NCCO |
|
AD31205 | 0.12 | 211.22 | C10H13O4N | COc1cc(O)ccc1C(=O)NCCO |
|
AD31206 | 0.61 | 218.24 | C10H12ON5 | COC1(C)CN(c2ncnc3c2N=C[N]3)C1 |
|
AD31207 | 1.19 | 195.22 | C10H13O3N | CCOc1cc(OC)cc(C(N)=O)c1 |
|
AD31208 | 1.45 | 204.02 | C6H6O2NBr | Cc1cc(Br)oc1C(N)=O |
|
AD31209 | -0.75 | 213.24 | C9H15O3N3 | COCCn1cc(C(=O)NCCO)cn1 |
|
AD31210 | -0.51 | 216.26 | C8H12O3N2S | O=S(=O)(Cc1cccnc1)NCCO |