General Information of the Compound
| Compound ID |
CP0551425
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-hexyl-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
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| Structure |
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| Formula |
C23H29F4N3O3S
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| Molecular Weight |
503.562
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| Canonical SMILES |
CCCCCCc1nc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
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| InChI |
InChI=1S/C23H29F4N3O3S/c1-4-5-6-7-8-19-17(10-12-21(29-19)23(25,26)27)14-28-22(31)15(2)16-9-11-20(18(24)13-16)30-34(3,32)33/h9-13,15,30H,4-8,14H2,1-3H3,(H,28,31)
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| InChIKey |
QPTPIQFMSSSTLB-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