General Information of the Compound
| Compound ID |
CP0285464
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| Compound Name |
2-((2-(3-methoxyphenethyl)phenoxy)methyl)pyridine
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| Structure |
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| Formula |
C21H21NO2
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| Molecular Weight |
319.404
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| Canonical SMILES |
COc1cccc(CCc2ccccc2OCc2ccccn2)c1
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| InChI |
InChI=1S/C21H21NO2/c1-23-20-10-6-7-17(15-20)12-13-18-8-2-3-11-21(18)24-16-19-9-4-5-14-22-19/h2-11,14-15H,12-13,16H2,1H3
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| InChIKey |
SVQZVYLEABSIDJ-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