General Information of the Compound
| Compound ID |
CP0389808
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| Compound Name |
(5Z)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-3-(2-methoxyethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
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| Structure |
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| Formula |
C13H12BrNO3S2
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| Molecular Weight |
374.281
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| Canonical SMILES |
COCCN1C(=S)S\C(=C/c2ccc(O)c(Br)c2)C1=O
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| InChI |
InChI=1S/C13H12BrNO3S2/c1-18-5-4-15-12(17)11(20-13(15)19)7-8-2-3-10(16)9(14)6-8/h2-3,6-7,16H,4-5H2,1H3/b11-7-
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| InChIKey |
USIPWYRCSMXLLQ-XFFZJAGNSA-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