General Information of the Compound
| Compound ID |
CP0465761
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| Compound Name |
3-[2-(4-chloro-2-methoxyphenoxy)ethoxy]-6-methyl-2-nitropyridine
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| Structure |
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| Formula |
C15H15ClN2O5
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| Molecular Weight |
338.747
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| Canonical SMILES |
COc1cc(Cl)ccc1OCCOc1ccc(C)nc1[N+]([O-])=O
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| InChI |
InChI=1S/C15H15ClN2O5/c1-10-3-5-13(15(17-10)18(19)20)23-8-7-22-12-6-4-11(16)9-14(12)21-2/h3-6,9H,7-8H2,1-2H3
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| InChIKey |
SSEVJABLEYFMJO-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