General Information of the Compound
| Compound ID |
CP0407585
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| Compound Name |
1-(2-methoxyphenyl)-4-[[3-(2-methoxyphenyl)phenyl]methyl]piperazine
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| Structure |
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| Formula |
C25H28N2O2
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| Molecular Weight |
388.511
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| Canonical SMILES |
COc1ccccc1N1CCN(Cc2cccc(c2)-c2ccccc2OC)CC1
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| InChI |
InChI=1S/C25H28N2O2/c1-28-24-12-5-3-10-22(24)21-9-7-8-20(18-21)19-26-14-16-27(17-15-26)23-11-4-6-13-25(23)29-2/h3-13,18H,14-17,19H2,1-2H3
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| InChIKey |
PNEHEWJNLWGRSQ-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