General Information of the Compound
| Compound ID |
CP0911040
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| Compound Name |
2-[6-(8-fluoro-2-naphthyl)-2-oxo-1H-pyridin-3-yl]-3-methyl-N-thiazol-2-yl-butanamide
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| Structure |
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| Formula |
C23H20FN3O2S
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| Molecular Weight |
421.497
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| Canonical SMILES |
CC(C)C(C(=O)Nc1nccs1)c1ccc(-c2ccc3cccc(F)c3c2)[nH]c1=O
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| InChI |
InChI=1S/C23H20FN3O2S/c1-13(2)20(22(29)27-23-25-10-11-30-23)16-8-9-19(26-21(16)28)15-7-6-14-4-3-5-18(24)17(14)12-15/h3-13,20H,1-2H3,(H,26,28)(H,25,27,29)
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| InChIKey |
KACPXLOEGJNMLQ-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