General Information of the Compound
| Compound ID |
CP0446661
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| Compound Name |
2-(4-Methanesulfonylamino-phenyl)-N-octadec-9-enyl-acetamide
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| Structure |
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| Formula |
C27H46N2O3S
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| Molecular Weight |
478.743
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| Canonical SMILES |
CCCCCCCC\C=C/CCCCCCCCNC(=O)Cc1ccc(NS(C)(=O)=O)cc1
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| InChI |
InChI=1S/C27H46N2O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28-27(30)24-25-19-21-26(22-20-25)29-33(2,31)32/h10-11,19-22,29H,3-9,12-18,23-24H2,1-2H3,(H,28,30)/b11-10-
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| InChIKey |
VQQZEYGFUDENKO-KHPPLWFESA-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