General Information of the Compound
| Compound ID |
CP0435100
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| Compound Name |
3-Methoxy-5-(6-methoxy-3-methyl-3,4-dihydronaphthalen-2-yl)pyridine
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| Structure |
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| Formula |
C18H19NO2
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| Molecular Weight |
281.355
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| Canonical SMILES |
COc1ccc2C=C(C(C)Cc2c1)c1cncc(OC)c1
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| InChI |
InChI=1S/C18H19NO2/c1-12-6-14-7-16(20-2)5-4-13(14)9-18(12)15-8-17(21-3)11-19-10-15/h4-5,7-12H,6H2,1-3H3
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| InChIKey |
XAFWAVASAFRJHA-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
Protein ID: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial