General Information of the Compound
| Compound ID |
CP0436972
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| Compound Name |
3-(6-Methoxy-3-methyl-3,4-dihydronaphthalen-2-yl)pyridine
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| Structure |
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| Formula |
C17H17NO
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| Molecular Weight |
251.329
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| Canonical SMILES |
COc1ccc2C=C(C(C)Cc2c1)c1cccnc1
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| InChI |
InChI=1S/C17H17NO/c1-12-8-15-9-16(19-2)6-5-13(15)10-17(12)14-4-3-7-18-11-14/h3-7,9-12H,8H2,1-2H3
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| InChIKey |
CWCNJDDYBZNABL-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