General Information of the Compound
| Compound ID |
CP0517915
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| Compound Name |
5-[[5-[[3-(2,6-dimethylphenyl)phenyl]methoxy]thiophen-2-yl]methyl]-1,3-thiazolidine-2,4-dione
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| Structure |
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| Formula |
C23H21NO3S2
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| Molecular Weight |
423.559
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| Canonical SMILES |
Cc1cccc(C)c1-c1cccc(COc2ccc(CC3SC(=O)NC3=O)s2)c1
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| InChI |
InChI=1S/C23H21NO3S2/c1-14-5-3-6-15(2)21(14)17-8-4-7-16(11-17)13-27-20-10-9-18(28-20)12-19-22(25)24-23(26)29-19/h3-11,19H,12-13H2,1-2H3,(H,24,25,26)
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| InChIKey |
XPFFJMVSMHWYIK-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