General Information of the Compound
| Compound ID |
CP0634217
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| Compound Name |
5-(2-ethylphenoxy)-N-(2,4,6-trifluorobenzyl)pyridin-2-amine
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| Structure |
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| Formula |
C20H17F3N2O
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| Molecular Weight |
358.363
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| Canonical SMILES |
CCc1ccccc1Oc1ccc(NCc2c(F)cc(F)cc2F)nc1
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| InChI |
InChI=1S/C20H17F3N2O/c1-2-13-5-3-4-6-19(13)26-15-7-8-20(24-11-15)25-12-16-17(22)9-14(21)10-18(16)23/h3-11H,2,12H2,1H3,(H,24,25)
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| InChIKey |
PTWGRLVFLLMZSU-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