aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17381 | 6.01 | 1678.02 | C86H104O14N18S2 | Cc1c(N)nc(C(CC(N)=O)NCC(N)C(N)=O)nc1C(=O)NC(C(=O)NC(C)C(O)C(C)C(=O)NC(C(=O)NCCc1nc(-c2nc(C(=O)NCCCN(C)CCCN(Cc3ccc(OCc4ccccc4)c(OCc4ccccc4)c3)Cc3ccc(OCc4ccccc4)c(OCc4ccccc4)c3)cs2)cs1)C(C)O)C(O)c1c[nH]cn1 |
|
AD17382 | -0.61 | 344.46 | C16H32O4N4 | CC(C)C(N)C(=O)NC(CCC(N)=O)C(=O)NCCCCCCO |
|
AD17383 | 5.9 | 644.87 | C37H57O6N2F | CCC1OC(=O)CC(O)C(C)C(O)C(CCN2CC(C)CC(C)C2)CC(C)C(=NOCc2ccc(F)cc2)C=CC(C)=CC1CO |
|
AD17384 | -0.76 | 165.16 | C6H7ON5 | Cn1ncc2nc(N)[nH]c(=O)c21 |
|
AD17385 | 2.07 | 272.33 | C14H18ON5 | CC(=O)N(Cc1ncnc2c1N=C[N]2)C1CCCCC1 |
|
AD17386 | 6.38 | 537.35 | C30H18O7Cl2 | COc1cc(O)c(C(=O)c2ccc(OC(=O)c3ccc(Cl)cc3)cc2)c(OC(=O)c2ccc(Cl)cc2)c1 |
|
AD17387 | 4.96 | 502.2 | C20H22O5Br2 | COc1cc(O)c(C(=O)c2ccc(OCCCBr)cc2)c(OCCCBr)c1 |
|
AD17388 | -1.42 | 429.43 | C14H28O8N3PS | CNC(=O)CSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)O |
|
AD17389 | 1.49 | 318.28 | C16H14O7 | COc1ccc(C2Oc3cc(O)cc(O)c3C(=O)C2O)cc1O |
|
AD17390 | -7.21 | 1084.19 | C47H77O18N11 | CCCCCCCCCCCC(O)C(O)C(O)CC1CC(=O)NC(CO)C(=O)NC(C(O)c2ccc(O)cc2)C(=O)NC(CCN)C(=O)NCC(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(C(O)C(N)=O)C(=O)N1 |