General Information of the Compound
| Compound ID |
CP0441504
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| Compound Name |
1-[4-(4-Methyl-benzyl)-piperidin-1-yl]-3-(naphthalen-1-yloxy)-propan-2-ol
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| Structure |
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| Formula |
C26H31NO2
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| Molecular Weight |
389.539
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| Canonical SMILES |
Cc1ccc(CC2CCN(CC(O)COc3cccc4ccccc34)CC2)cc1
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| InChI |
InChI=1S/C26H31NO2/c1-20-9-11-21(12-10-20)17-22-13-15-27(16-14-22)18-24(28)19-29-26-8-4-6-23-5-2-3-7-25(23)26/h2-12,22,24,28H,13-19H2,1H3
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| InChIKey |
BYSPLGDSEANDCT-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