General Information of the Compound
| Compound ID |
CP0453516
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| Compound Name |
N-[2-(4-tert-butylphenyl)butyl]propane-2-sulfonamide
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| Structure |
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| Formula |
C17H29NO2S
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| Molecular Weight |
311.491
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| Canonical SMILES |
CCC(CNS(=O)(=O)C(C)C)c1ccc(cc1)C(C)(C)C
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| InChI |
InChI=1S/C17H29NO2S/c1-7-14(12-18-21(19,20)13(2)3)15-8-10-16(11-9-15)17(4,5)6/h8-11,13-14,18H,7,12H2,1-6H3
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| InChIKey |
VYXUHCXIPOIIAP-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