General Information of the Compound
| Compound ID |
CP0386446
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| Compound Name |
3-(5-hexyl-2-oxo-1,3-oxazolidin-3-yl)benzonitrile
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| Structure |
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| Formula |
C16H20N2O2
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| Molecular Weight |
272.348
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| Canonical SMILES |
CCCCCCC1CN(C(=O)O1)c1cccc(c1)C#N
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| InChI |
InChI=1S/C16H20N2O2/c1-2-3-4-5-9-15-12-18(16(19)20-15)14-8-6-7-13(10-14)11-17/h6-8,10,15H,2-5,9,12H2,1H3
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| InChIKey |
GIGURPRBQAMLFJ-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