General Information of the Compound
| Compound ID |
CP0389900
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| Compound Name |
5-[[4-[2-[(4-methoxyphenyl)-phenylmethoxy]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
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| Structure |
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| Formula |
C26H25NO5S
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| Molecular Weight |
463.555
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| Canonical SMILES |
COc1ccc(cc1)C(OCCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccccc1
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| InChI |
InChI=1S/C26H25NO5S/c1-30-21-13-9-20(10-14-21)24(19-5-3-2-4-6-19)32-16-15-31-22-11-7-18(8-12-22)17-23-25(28)27-26(29)33-23/h2-14,23-24H,15-17H2,1H3,(H,27,28,29)
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| InChIKey |
PTEHKMYYCGEPMW-UHFFFAOYSA-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