General Information of the Compound
| Compound ID |
CP0457228
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| Compound Name |
N,N'-bis[(3-hydroxy-4-methoxyphenyl)methyl]nonanediamide
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| Structure |
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| Formula |
C25H34N2O6
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| Molecular Weight |
458.555
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| Canonical SMILES |
COc1ccc(CNC(=O)CCCCCCCC(=O)NCc2ccc(OC)c(O)c2)cc1O
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| InChI |
InChI=1S/C25H34N2O6/c1-32-22-12-10-18(14-20(22)28)16-26-24(30)8-6-4-3-5-7-9-25(31)27-17-19-11-13-23(33-2)21(29)15-19/h10-15,28-29H,3-9,16-17H2,1-2H3,(H,26,30)(H,27,31)
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| InChIKey |
CVZKHXWHEOFMNC-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