General Information of the Compound
| Compound ID |
CP0514704
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| Compound Name |
6-(N-(4-hydroxynonyl)methylsulfonamido)hexanoic acid
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| Structure |
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| Formula |
C16H33NO5S
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| Molecular Weight |
351.509
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| Canonical SMILES |
CCCCCC(O)CCCN(CCCCCC(O)=O)S(C)(=O)=O
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| InChI |
InChI=1S/C16H33NO5S/c1-3-4-6-10-15(18)11-9-14-17(23(2,21)22)13-8-5-7-12-16(19)20/h15,18H,3-14H2,1-2H3,(H,19,20)
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| InChIKey |
WPTYIXZEPBHXPQ-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