aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07091 | 1.24 | 368.39 | C20H20O5N2 | C=CC1C(O)OC=C2C(=O)N3CCC4(C(=O)Nc5cc(O)ccc54)C3CC21 |
|
AD07092 | 6.01 | 330.42 | C19H14N4S | Cc1c(N=Nc2ccccc2)c(-c2ccccc2)[nH]c(=S)c1C#N |
|
AD07093 | -10.46 | 2340.68 | C105H166O29N32 | CCC(C)C(N)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(N)=O)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC(N)=O)C(=O)OC(=O)C1(C(=O)C2CCCN2C(=O)C(CCCNC(=N)N)NC(=O)C2CCCN2C(=O)C(N)CC(C)C)CCCN1C(=O)C(CCCNC(=N)N)NC(=O)C1CCCN1C(=O)C1CCCN1C(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)CNC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C(N)C(C)C)C(C)O |
|
AD07094 | 1.58 | 107.16 | C7H9N | Cc1cccc(N)c1 |
|
AD07095 | 1.66 | 257.3 | C11H9N6S | Nc1nc2c(c(SCc3ccccn3)n1)N=C[N]2 |
|
AD07096 | 3.09 | 178.23 | C14H10 | C(#Cc1ccccc1)c1ccccc1 |
|
AD07097 | -0.4 | 204.22 | C9H16O5 | CC1OC(O)C2OC(C)(C)OC2C1O |
|
AD07098 | 4.5 | 586.76 | C31H54O10 | CCCCCC1CCCCCCCCCC(=O)OC2C(OC(C)C(O)C2O)OC2C(O1)OC(C)C1OC(C)(C)OC12 |
|
AD07099 | 4.68 | 430.63 | C27H42O4 | CC1CCC2(OC1)OC1C(O)C3C4CC=C5CC(O)CCC5(C)C4CCC3(C)C1C2C |
|
AD07100 | 5.58 | 444.66 | C28H44O4 | CC(COC(=O)CCC(C)C)=C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3CCC12C |