General Information of the Compound
| Compound ID |
CP0926328
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| Compound Name |
N-(1,1-dioxothian-4-yl)-2-[6-(8-fluoro-2-naphthyl)-2-oxo-1H-pyridin-3-yl]-3-methyl-butanamide
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| Structure |
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| Formula |
C25H27FN2O4S
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| Molecular Weight |
470.566
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| Canonical SMILES |
CC(C)C(C(=O)NC1CCS(=O)(=O)CC1)c1ccc(-c2ccc3cccc(F)c3c2)[nH]c1=O
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| InChI |
InChI=1S/C25H27FN2O4S/c1-15(2)23(25(30)27-18-10-12-33(31,32)13-11-18)19-8-9-22(28-24(19)29)17-7-6-16-4-3-5-21(26)20(16)14-17/h3-9,14-15,18,23H,10-13H2,1-2H3,(H,27,30)(H,28,29)
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| InChIKey |
FKFZFOJZYLJIAU-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