General Information of the Compound
| Compound ID |
CP0238502
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| Compound Name |
1-[(E)-3-phenylprop-2-enyl]-4-[3-(3-phenylpropoxy)propyl]piperazine
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| Structure |
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| Formula |
C25H34N2O
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| Molecular Weight |
378.56
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| Canonical SMILES |
C(COCCCc1ccccc1)CN1CCN(C\C=C\c2ccccc2)CC1
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| InChI |
InChI=1S/C25H34N2O/c1-3-10-24(11-4-1)14-7-16-26-18-20-27(21-19-26)17-9-23-28-22-8-15-25-12-5-2-6-13-25/h1-7,10-14H,8-9,15-23H2/b14-7+
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| InChIKey |
QBRDAXMNYIKKBX-VGOFMYFVSA-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