General Information of the Compound
| Compound ID |
CP0441037
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| Compound Name |
3-[(Z)-dec-1-enyl]-6-(3-methoxypropyl)-2,4-dimethylpyridine
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| Structure |
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| Formula |
C21H35NO
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| Molecular Weight |
317.517
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| Canonical SMILES |
CCCCCCCC\C=C/c1c(C)cc(CCCOC)nc1C
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| InChI |
InChI=1S/C21H35NO/c1-5-6-7-8-9-10-11-12-15-21-18(2)17-20(22-19(21)3)14-13-16-23-4/h12,15,17H,5-11,13-14,16H2,1-4H3/b15-12-
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| InChIKey |
NVVNWMUZZOSCFN-QINSGFPZSA-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