General Information of the Compound
| Compound ID |
CP0480520
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| Compound Name |
3-[2-(2,4-dimethylphenoxy)ethoxy]-6-methyl-2-nitro-pyridine
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| Structure |
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| Formula |
C16H18N2O4
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| Molecular Weight |
302.33
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| Canonical SMILES |
Cc1ccc(OCCOc2ccc(C)nc2[N+]([O-])=O)c(C)c1
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| InChI |
InChI=1S/C16H18N2O4/c1-11-4-6-14(12(2)10-11)21-8-9-22-15-7-5-13(3)17-16(15)18(19)20/h4-7,10H,8-9H2,1-3H3
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| InChIKey |
BAWCICUTWLKNAE-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