aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19981 | 4.98 | 304.84 | C18H17OClS | CSc1ccc(Cc2ccc3c(c2Cl)CCCO3)cc1 |
|
AD19982 | -2.54 | 552.22 | C12H18O13N5FP3 | COP(=O)([O-])OP(=O)([O-])OP(=O)(O)OCC1OC(n2c[n+](C)c3c(=O)[nH]c(N)nc32)C(F)C1O |
|
AD19983 | 3.02 | 227.26 | C14H13O2N | CC(=O)Nc1cccc(-c2ccccc2O)c1 |
|
AD19984 | 4.58 | 300.79 | C19H17O2Cl | Clc1c(Cc2ccc(C3CC3)cc2)ccc2c1OCCO2 |
|
AD19985 | 2.85 | 541.73 | C29H51O8N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C2(C)CC(C)=C(O2)C(C)C(O)C1C |
|
AD19986 | -1.73 | 2237.84 | C110H134O29N21Cl | Cc1cccc(CC(=O)NC(CC(N)=O)C(=O)NCC2C(=O)NC(c3ccc(O)cc3)C(=O)NC(CCCN)C(=O)NC(C(C)C)C(=O)NC(c3ccc(O)cc3)C(=O)NC(c3ccc(O)cc3)C(=O)NC(C(C)O)C(=O)NC(Cc3ccccc3)C(=O)NC(CCCN)C(=O)NC(c3ccc(O)cc3)C(=O)NC(C(C)O)C(=O)NC(c3ccc(O)cc3)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(c3ccc(O)c(Cl)c3)C(=O)OC2C(N)=O)c1 |
|
AD19987 | 4.3 | 383.27 | C18H17N5Br | CCCCC#Cc1nc2c(c(NCc3cccc(Br)c3)n1)N=C[N]2 |
|
AD19988 | 5.01 | 408.5 | C27H24O2N2 | CC1(C)c2ccccc2C(=O)c2c1[nH]c1cc(C(=O)NCCc3ccccc3)ccc21 |
|
AD19989 | 3.64 | 378.55 | C23H38O4 | COC1=C2CC(O)CCC2(C)C2CCC3(C)C(CC(O)C3(O)C(C)C)C2C1 |
|
AD19990 | 2.89 | 1169.14 | C59H57O17N8F | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(-c4cccc(F)c4)c3)Oc3cc2cc(c3O)Oc2ccc(cc2)C1O |