General Information of the Compound
| Compound ID |
CP0501677
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| Compound Name |
3-isobutyl-2-(3-(4-methoxyphenyl)pyridin-4-yl)thiazolidin-4-one
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| Structure |
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| Formula |
C19H22N2O2S
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| Molecular Weight |
342.464
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| Canonical SMILES |
COc1ccc(cc1)-c1cnccc1C1SCC(=O)N1CC(C)C
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| InChI |
InChI=1S/C19H22N2O2S/c1-13(2)11-21-18(22)12-24-19(21)16-8-9-20-10-17(16)14-4-6-15(23-3)7-5-14/h4-10,13,19H,11-12H2,1-3H3
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| InChIKey |
PZEJSLYZZGUHMD-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