General Information of the Compound
| Compound ID |
CP0416884
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| Compound Name |
2,6-difluoro-4-[4-(oxan-4-yl)pyridin-3-yl]phenol
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| Structure |
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| Formula |
C16H15F2NO2
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| Molecular Weight |
291.297
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| Canonical SMILES |
Oc1c(F)cc(cc1F)-c1cnccc1C1CCOCC1
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| InChI |
InChI=1S/C16H15F2NO2/c17-14-7-11(8-15(18)16(14)20)13-9-19-4-1-12(13)10-2-5-21-6-3-10/h1,4,7-10,20H,2-3,5-6H2
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| InChIKey |
VACMZWAHKWHHMN-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