General Information of the Compound
Compound ID |
CP0944701
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Compound Name |
methyl 6-((naphthalen-2-yloxy)methyl)picolinate
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Structure |
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Formula |
C18H15NO3
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Molecular Weight |
293.322
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Canonical SMILES |
COC(=O)c1cccc(COc2ccc3ccccc3c2)n1
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InChI |
InChI=1S/C18H15NO3/c1-21-18(20)17-8-4-7-15(19-17)12-22-16-10-9-13-5-2-3-6-14(13)11-16/h2-11H,12H2,1H3
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InChIKey |
BRCCTZORIZQGTJ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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