aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07401 | 1.33 | 256.33 | C11H16O3N2S | CCCCNS(=O)(=O)c1cccc(NC=O)c1 |
|
AD07402 | -0.98 | 2241.87 | C110H138O29N21Cl | CCCC=CC=CCC(=O)NC(CC(N)=O)C(=O)NCC1C(=O)NC(c2ccc(O)cc2)C(=O)NC(CCCN)C(=O)NC(C(C)C)C(=O)NC(c2ccc(O)cc2)C(=O)NC(c2ccc(O)cc2)C(=O)NC(C(C)O)C(=O)NC(Cc2ccccc2)C(=O)NC(CCCN)C(=O)NC(c2ccc(O)cc2)C(=O)NC(C(C)O)C(=O)NC(c2ccc(O)cc2)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(c2ccc(O)c(Cl)c2)C(=O)OC1C(N)=O |
|
AD07403 | 4.51 | 720.94 | C40H64O11 | COCC(O)CC1OC(O)(C(O)C2CC(=O)C(C)=CC(C)=CC(C)=CC(C)C(O)C=CC(C)=CCCC(OC(C)=O)C(OC)C2)C(C)C(O)C1C |
|
AD07404 | 0.17 | 103.08 | C2H5O2N3 | CNC(=O)N=NO |
|
AD07405 | 2.88 | 284.27 | C16H12O5 | COc1cc(-c2coc3cc(O)ccc3c2=O)ccc1O |
|
AD07406 | 0.43 | 316.88 | C4H2O2N2BrI | O=c1[nH]c(I)c(Br)c(=O)[nH]1 |
|
AD07407 | 1.58 | 215.26 | C12H13ON3 | C=CCn1cnc2cc(C(=O)NC)ccc21 |
|
AD07408 | 0.09 | 176.65 | C8H13ON2Cl | CC(Cl)CNC(=O)C1CCN1 |
|
AD07409 | 4.61 | 510.36 | C22H21N7I | Ic1cccc(CNc2nc(NCCC3CNc4ccccc43)nc3c2N=C[N]3)c1 |
|
AD07410 | 4.34 | 494.65 | C25H32O2N7S | CN(C)c1cccc2c(S(=O)(=O)NCCCCCCCCNc3ncnc4c3N=C[N]4)cccc12 |