General Information of the Compound
| Compound ID |
CP0496045
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| Compound Name |
1-(2-(3-phenethylbenzofuran-2-yl)ethyl)piperidine
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| Structure |
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| Formula |
C23H27NO
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| Molecular Weight |
333.475
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| Canonical SMILES |
C(Cc1oc2ccccc2c1CCc1ccccc1)N1CCCCC1
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| InChI |
InChI=1S/C23H27NO/c1-3-9-19(10-4-1)13-14-21-20-11-5-6-12-22(20)25-23(21)15-18-24-16-7-2-8-17-24/h1,3-6,9-12H,2,7-8,13-18H2
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| InChIKey |
QLOZPGUYIBBWAL-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