General Information of the Compound
| Compound ID |
CP0490371
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| Compound Name |
2-ethoxy-6-[[4-[1-(2-fluoroethyl)-4-pyridin-4-ylpyrazol-3-yl]phenoxy]methyl]pyridine
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| Structure |
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| Formula |
C24H23FN4O2
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| Molecular Weight |
418.472
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| Canonical SMILES |
CCOc1cccc(COc2ccc(cc2)-c2nn(CCF)cc2-c2ccncc2)n1
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| InChI |
InChI=1S/C24H23FN4O2/c1-2-30-23-5-3-4-20(27-23)17-31-21-8-6-19(7-9-21)24-22(16-29(28-24)15-12-25)18-10-13-26-14-11-18/h3-11,13-14,16H,2,12,15,17H2,1H3
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| InChIKey |
LCGJPIRXLGNTOZ-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