General Information of the Compound
| Compound ID |
CP0746913
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| Compound Name |
5-(4-(2-(1-(5-phenylpyridin-2-yl)ethylideneaminooxy)ethoxy)benzyl)thiazolidine-2,4-dione
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| Structure |
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| Formula |
C25H23N3O4S
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| Molecular Weight |
461.543
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| Canonical SMILES |
C/C(=N\OCCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccc(-c2ccccc2)cn1
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| InChI |
InChI=1S/C25H23N3O4S/c1-17(22-12-9-20(16-26-22)19-5-3-2-4-6-19)28-32-14-13-31-21-10-7-18(8-11-21)15-23-24(29)27-25(30)33-23/h2-12,16,23H,13-15H2,1H3,(H,27,29,30)/b28-17+
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| InChIKey |
SKFBHBYQZHUEME-OGLMXYFKSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound