aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD24241 | 0.7 | 260.3 | C13H16O2N4 | Cc1cc2c(cc1C)N(C)C1NC(=O)NC(=O)C1N2 |
|
AD24242 | 0.24 | 270.25 | C13H10O3N4 | Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C)c2cc1C=O |
|
AD24243 | 0.73 | 272.39 | C13H28O2N4 | CC(=O)NC(=O)NCN(C)CCC(C)C(C)CCN |
|
AD24244 | 0.06 | 293.24 | C11H11O5N5 | Cn1cc(CNC(=O)c2cc([N+](=O)[O-])cc(O)c2O)nn1 |
|
AD24245 | 0.37 | 318.38 | C16H22O3N4 | Cc1cc2c(cc1C)N1C(O)CCC13C(O)NC(=O)NC3N2C |
|
AD24246 | -0.31 | 496.32 | C14H27O12N2FP2 | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCC(F)C(=O)O |
|
AD24247 | 7.67 | 980.09 | C38H45O14N9S4 | Cc1cc2nc3c(=O)n(OCCS(O)(O)c4ccc(NNc5c(S(O)(O)O)cc6cc(S(O)(O)O)c(NNc7ccc(S(C)(O)O)cc7)c(O)c6c5N)cc4)c(=O)nc-3n(C)c2cc1C |
|
AD24248 | 1.5 | 258.28 | C13H14O2N4 | Cc1cc2c(cc1C)N(C)c1[nH]c(=O)[nH]c(=O)c1N2 |
|
AD24249 | 1.16 | 291.2 | C10H14O7NP | COP(=O)(O)Oc1c(C)c(O)nc(CC(=O)O)c1C |
|
AD24250 | 7.96 | 774.94 | C34H68O11N2P2S | CCCCCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |