General Information of the Compound
| Compound ID |
CP0284282
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| Compound Name |
4-tert-butyl-N-[[2-chloro-4-(ethylsulfonylamino)phenyl]methyl]benzamide
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| Structure |
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| Formula |
C20H25ClN2O3S
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| Molecular Weight |
408.951
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| Canonical SMILES |
CCS(=O)(=O)Nc1ccc(CNC(=O)c2ccc(cc2)C(C)(C)C)c(Cl)c1
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| InChI |
InChI=1S/C20H25ClN2O3S/c1-5-27(25,26)23-17-11-8-15(18(21)12-17)13-22-19(24)14-6-9-16(10-7-14)20(2,3)4/h6-12,23H,5,13H2,1-4H3,(H,22,24)
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| InChIKey |
DGWJNQHPEZUJAH-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