General Information of the Compound
| Compound ID |
CP0496338
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| Compound Name |
3-[2-(2,4-dichlorophenoxy)ethoxy]-2-nitro-pyridine
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| Structure |
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| Formula |
C13H10Cl2N2O4
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| Molecular Weight |
329.139
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| Canonical SMILES |
[O-][N+](=O)c1ncccc1OCCOc1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C13H10Cl2N2O4/c14-9-3-4-11(10(15)8-9)20-6-7-21-12-2-1-5-16-13(12)17(18)19/h1-5,8H,6-7H2
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| InChIKey |
ISKSAGKSHGHMMJ-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