General Information of the Compound
| Compound ID |
CP0439525
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| Compound Name |
2-[2-[2-(2-phenylmethoxyphenoxy)ethylamino]ethoxy]benzene-1,3-diol
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| Structure |
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| Formula |
C23H25NO5
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| Molecular Weight |
395.455
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| Canonical SMILES |
Oc1cccc(O)c1OCCNCCOc1ccccc1OCc1ccccc1
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| InChI |
InChI=1S/C23H25NO5/c25-19-9-6-10-20(26)23(19)28-16-14-24-13-15-27-21-11-4-5-12-22(21)29-17-18-7-2-1-3-8-18/h1-12,24-26H,13-17H2
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| InChIKey |
ADSQCTGZHJXUFN-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