General Information of the Compound
| Compound ID |
CP0861170
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| Compound Name |
5-((5-(6-methoxypyridin-3-yl)thiophen-2-yl)methylene)-2-thioxoimidazolidin-4-one
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| Structure |
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| Formula |
C14H11N3O2S2
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| Molecular Weight |
317.395
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| Canonical SMILES |
COc1ccc(-c2ccc(/C=C3/NC(=S)NC3=O)s2)cn1
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| InChI |
InChI=1S/C14H11N3O2S2/c1-19-12-5-2-8(7-15-12)11-4-3-9(21-11)6-10-13(18)17-14(20)16-10/h2-7H,1H3,(H2,16,17,18,20)/b10-6+
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| InChIKey |
YIQOWGBCWWJUEY-UXBLZVDNSA-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