General Information of the Compound
| Compound ID |
CP0654953
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| Compound Name |
5-(4-(2-(1-(4-(pyridin-4-yl)phenyl)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(-c2ccncc2)cc1
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| InChI |
InChI=1S/C25H23N3O4S/c1-17(19-4-6-20(7-5-19)21-10-12-26-13-11-21)28-32-15-14-31-22-8-2-18(3-9-22)16-23-24(29)27-25(30)33-23/h2-13,23H,14-16H2,1H3,(H,27,29,30)/b28-17+
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| InChIKey |
QWRDGVGHRRQPHC-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