General Information of the Compound
| Compound ID |
CP0390769
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| Compound Name |
ethyl 1-(1,3-benzodioxol-5-yl)-2-(6-methylpyridin-2-yl)imidazole-4-carboxylate
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| Structure |
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| Formula |
C19H17N3O4
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| Molecular Weight |
351.362
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| Canonical SMILES |
CCOC(=O)c1cn(c(n1)-c1cccc(C)n1)-c1ccc2OCOc2c1
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| InChI |
InChI=1S/C19H17N3O4/c1-3-24-19(23)15-10-22(13-7-8-16-17(9-13)26-11-25-16)18(21-15)14-6-4-5-12(2)20-14/h4-10H,3,11H2,1-2H3
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| InChIKey |
IUGGDGLFUYUNTK-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