General Information of the Compound
| Compound ID |
CP0846390
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| Compound Name |
4-((2-fluorophenoxy)methyl)-6-methyl-2-(pyridin-2-yl)pyrimidine
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| Structure |
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| Formula |
C17H14FN3O
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| Molecular Weight |
295.317
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| Canonical SMILES |
Cc1cc(COc2ccccc2F)nc(-c2ccccn2)n1
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| InChI |
InChI=1S/C17H14FN3O/c1-12-10-13(11-22-16-8-3-2-6-14(16)18)21-17(20-12)15-7-4-5-9-19-15/h2-10H,11H2,1H3
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| InChIKey |
IKMYSDYCECULBS-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