General Information of the Compound
| Compound ID |
CP0778995
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| Compound Name |
5-(4-(2-(1-(biphenyl-4-yl)butylideneaminooxy)ethoxy)benzyl)thiazolidine-2,4-dione
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| Structure |
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| Formula |
C28H28N2O4S
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| Molecular Weight |
488.609
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| Canonical SMILES |
CCC/C(=N\OCCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccc(-c2ccccc2)cc1
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| InChI |
InChI=1S/C28H28N2O4S/c1-2-6-25(23-13-11-22(12-14-23)21-7-4-3-5-8-21)30-34-18-17-33-24-15-9-20(10-16-24)19-26-27(31)29-28(32)35-26/h3-5,7-16,26H,2,6,17-19H2,1H3,(H,29,31,32)/b30-25+
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| InChIKey |
CARUBENMPHPZTJ-QCWLDUFUSA-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