General Information of the Compound
| Compound ID |
CP0226507
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| Compound Name |
N-[[2-chloro-4-(methylsulfamoyl)phenyl]methyl]-6-(3,3,3-trifluoropropoxy)pyridine-3-carboxamide
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| Structure |
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| Formula |
C17H17ClF3N3O4S
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| Molecular Weight |
451.854
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| Canonical SMILES |
CNS(=O)(=O)c1ccc(CNC(=O)c2ccc(OCCC(F)(F)F)nc2)c(Cl)c1
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| InChI |
InChI=1S/C17H17ClF3N3O4S/c1-22-29(26,27)13-4-2-11(14(18)8-13)9-24-16(25)12-3-5-15(23-10-12)28-7-6-17(19,20)21/h2-5,8,10,22H,6-7,9H2,1H3,(H,24,25)
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| InChIKey |
FPXKSZDQIMNYEO-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