aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05591 | 4.92 | 1283.1 | C65H57O17N9Cl2 | CN(C)CCN(C)C(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD05592 | 2.46 | 439.58 | C19H21O5NS3 | COC(=O)NC(C(C)=O)=C1C(=CCSSSC)C(C)(O)C#CC=CC#CC1O |
|
AD05593 | 3.29 | 370.49 | C22H30O3N2 | Cc1cc(O)ccc1Cc1ccc(CCCNC(=O)NC(C)(C)CO)cc1 |
|
AD05594 | 1.38 | 190.23 | C9H12N5 | CCC(C)C1=Nc2c(N)ncnc2[N]1 |
|
AD05595 | 0.05 | 1440.02 | C46H66O30N11P5S | COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(CCn2cnc3c(CCSC)nc(N)nc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)O |
|
AD05596 | 1.97 | 506.43 | C19H32O8N4P2 | Cc1cn(C2CC(OP(CCC#N)N(C(C)C)C(C)C)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O |
|
AD05597 | 2.15 | 258.27 | C15H14O4 | O=C(COc1ccc(O)c(CO)c1)c1ccccc1 |
|
AD05598 | 6.48 | 608.77 | C36H48O8 | CCC(C)C1OC2(CC3CC(CC=C(C)C(O)C(C)C=CC=C4COc5cc(C)cc(c54)C(=O)O3)O2)CC(OC(C)=O)C1C |
|
AD05599 | 2.05 | 129.2 | C7H15ON | C=NOCCC(C)(C)C |
|
AD05600 | -2.36 | 1105.95 | C35H50O20N9P3S3 | COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1C2ON(C)CC1(COP(O)(=S)OC1C3ON(C)CC1(CO)OC3n1cc(C)c(N)nc1=O)OC2n1cc(C)c(=O)[nH]c1=O |