General Information of the Compound
| Compound ID |
CP0427619
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[(4-propan-2-ylphenyl)methyl]propanamide
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| Structure |
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| Formula |
C20H25FN2O3S
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| Molecular Weight |
392.496
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| Canonical SMILES |
CC(C)c1ccc(CNC(=O)C(C)c2ccc(NS(C)(=O)=O)c(F)c2)cc1
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| InChI |
InChI=1S/C20H25FN2O3S/c1-13(2)16-7-5-15(6-8-16)12-22-20(24)14(3)17-9-10-19(18(21)11-17)23-27(4,25)26/h5-11,13-14,23H,12H2,1-4H3,(H,22,24)
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| InChIKey |
CHKDHCHIZLAWCO-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