General Information of the Compound
| Compound ID |
CP0496134
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| Compound Name |
6-chloro-3-[2-(2,4-dichlorophenoxy)ethoxy]-2-nitropyridine
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| Structure |
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| Formula |
C13H9Cl3N2O4
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| Molecular Weight |
363.584
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| Canonical SMILES |
[O-][N+](=O)c1nc(Cl)ccc1OCCOc1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C13H9Cl3N2O4/c14-8-1-2-10(9(15)7-8)21-5-6-22-11-3-4-12(16)17-13(11)18(19)20/h1-4,7H,5-6H2
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| InChIKey |
SZGSESOGCGRDPH-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