General Information of the Compound
| Compound ID |
CP0375895
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| Compound Name |
2-(2-ethoxyphenoxy)-N-[2-(2-phenylmethoxyphenoxy)ethyl]ethanamine
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| Structure |
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| Formula |
C25H29NO4
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| Molecular Weight |
407.51
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| Canonical SMILES |
CCOc1ccccc1OCCNCCOc1ccccc1OCc1ccccc1
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| InChI |
InChI=1S/C25H29NO4/c1-2-27-22-12-6-7-13-23(22)28-18-16-26-17-19-29-24-14-8-9-15-25(24)30-20-21-10-4-3-5-11-21/h3-15,26H,2,16-20H2,1H3
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| InChIKey |
IZMYNAZDOKXFDK-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT01089, Alpha-1A adrenergic receptor
Protein ID: PT01007, Alpha-1B adrenergic receptor
Protein ID: PT01004, Alpha-1D adrenergic receptor