General Information of the Compound
| Compound ID |
CP0141701
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| Compound Name |
1-[2-(2-Benzyl-phenoxy)-ethyl]-piperidine
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| Synonyms |
1-[2-(2-Benzyl-phenoxy)-ethyl]-piperidine
BDBM50151048
CHEMBL364565
SCHEMBL8773745
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| Structure |
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| Formula |
C20H25NO
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| Molecular Weight |
295.426
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| Canonical SMILES |
C(CN1CCCCC1)Oc1ccccc1Cc1ccccc1
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| InChI |
InChI=1S/C20H25NO/c1-3-9-18(10-4-1)17-19-11-5-6-12-20(19)22-16-15-21-13-7-2-8-14-21/h1,3-6,9-12H,2,7-8,13-17H2
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| InChIKey |
QKRCVHKKBOUVNT-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
Clinical Information about the Compound