aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14211 | 1.67 | 605.74 | C31H31O6N3S2 | NS(=O)(=O)c1ccc(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)c(S(=O)(=O)[O-])c1 |
|
AD14212 | 1.12 | 276.67 | C11H7ON7Cl | O=C(NNc1nc(Cl)nc2c1N=C[N]2)c1ccc[nH]1 |
|
AD14213 | -5.87 | 642.71 | C22H38O12N6S2 | CC(=O)NC1C(NC(=S)NCC(O)=C(O)CNC(=S)NC2OC(CO)C(O)C(O)C2NC(C)=O)OC(CO)C(O)C1O |
|
AD14214 | -1.94 | 147.17 | C6H13O3N | CC(O)C1NCC(O)C1O |
|
AD14215 | -1.57 | 353.33 | C16H19O8N | O=C(C=Cc1ccc(O)c(O)c1)NC1C(O)C(O)C2OCOC2C1O |
|
AD14216 | 0.05 | 284.25 | C13H10O3N5 | COc1cccc(C2=Nc3c(c(=O)[nH]c(N)nc3=O)[N]2)c1 |
|
AD14217 | 2.59 | 272.33 | C13H12ON4S | Cc1cc(NC(=O)c2ccc3scnc3c2)n(C)n1 |
|
AD14218 | 6.08 | 512.73 | C32H48O5 | CC(=O)OC1CC23CC24CCC(O)C(C)(C)C4CCC3C2(C)CC3OC(C(=O)C(C)C)=CC(C)C3C12C |
|
AD14219 | 2.73 | 305.29 | C18H11O4N | Cc1cc(O)c2c3c(ncc2c1)C(=O)c1c(O)cccc1C3=O |
|
AD14220 | 3.48 | 419.43 | C24H21O6N | Cc1cc(O)c2c(c1)C1OC(=O)C(CC(C)C)N1C1=C2C(=O)c2cccc(O)c2C1=O |