aglycones
Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
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AD00521 | 4.31 | 584.75 | C34H48O8 | CCC(C)C1OC2(C=CC1C)CC1CC(CC=C(C)C(O)C(C)C=CC=C3COC4C(O)C(C)=CC(C(=O)O1)C34O)O2 |
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AD00522 | 4.17 | 336.23 | C16H9N4Cl2S | Clc1ccc(C=CCSc2ncnc3c2C=N[N]3)c(Cl)c1 |
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AD00523 | 0.52 | 144.26 | C7H14NS | C[S+](C)C1C=CC(N)C1 |
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AD00524 | 4.62 | 270.53 | C14H4N2Cl3 | ClC1=Nc2cc3cc(Cl)c(Cl)cc3cc2[N]1 |
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AD00525 | 2.09 | 204.23 | C9H6ON3S | COc1ncnc2c1-c1ccsc1[N]2 |
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AD00526 | 4.42 | 359.46 | C21H23N6 | Cc1c(CCNc2ncnc3c2N=C[N]3)c2ccccc2n1C1CCCC1 |
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AD00527 | -0.11 | 85.11 | C4H7ON | O=CNC1CC1 |
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AD00528 | 4.88 | 418.62 | C26H42O4 | CC(C)COC(=O)C=CC1CCC2(O)C3CCC4CC(O)CCC4(C)C3CCC12C |
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AD00529 | 2.58 | 270.24 | C15H10O5 | O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12 |
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AD00530 | 3.46 | 301.41 | C17H19O2NS | CSc1ccccc1-c1cc(O)ccc1CCNC(C)=O |