General Information of the Compound
| Compound ID |
CP0428618
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| Compound Name |
(5Z)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
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| Structure |
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| Formula |
C18H14BrNO3S2
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| Molecular Weight |
436.352
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| Canonical SMILES |
COc1ccc(CN2C(=S)S\C(=C/c3ccc(O)c(Br)c3)C2=O)cc1
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| InChI |
InChI=1S/C18H14BrNO3S2/c1-23-13-5-2-11(3-6-13)10-20-17(22)16(25-18(20)24)9-12-4-7-15(21)14(19)8-12/h2-9,21H,10H2,1H3/b16-9-
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| InChIKey |
HYEWOVWAMIXRBK-SXGWCWSVSA-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