General Information of the Compound
| Compound ID |
CP0528144
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| Compound Name |
N-[4-[(1-butanoylpiperidin-4-yl)sulfamoyl]naphthalen-1-yl]-4-fluorobenzamide
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| Structure |
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| Formula |
C26H28FN3O4S
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| Molecular Weight |
497.592
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| Canonical SMILES |
CCCC(=O)N1CCC(CC1)NS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2)c2ccccc12
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| InChI |
InChI=1S/C26H28FN3O4S/c1-2-5-25(31)30-16-14-20(15-17-30)29-35(33,34)24-13-12-23(21-6-3-4-7-22(21)24)28-26(32)18-8-10-19(27)11-9-18/h3-4,6-13,20,29H,2,5,14-17H2,1H3,(H,28,32)
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| InChIKey |
LLEHETDEZNVDGI-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