General Information of the Compound
| Compound ID |
CP0488892
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| Compound Name |
3-cyano-N-(6-ethylpyridin-2-yl)-5-fluorobenzamide
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| Synonyms |
3-cyano-N-(6-ethylpyridin-2-yl)-5-fluorobenzamide
CHEMBL1209330
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| Structure |
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| Formula |
C15H12FN3O
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| Molecular Weight |
269.279
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| Canonical SMILES |
CCc1cccc(NC(=O)c2cc(F)cc(c2)C#N)n1
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| InChI |
InChI=1S/C15H12FN3O/c1-2-13-4-3-5-14(18-13)19-15(20)11-6-10(9-17)7-12(16)8-11/h3-8H,2H2,1H3,(H,18,19,20)
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| InChIKey |
LBPUNEZWEHBQQO-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
Clinical Information about the Compound