General Information of the Compound
| Compound ID |
CP0375057
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| Compound Name |
4-Benzyl-1-[2-methoxy-3-(naphthalen-1-yloxy)-propyl]-piperidine
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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 |
COC(COc1cccc2ccccc12)CN1CCC(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C26H31NO2/c1-28-24(20-29-26-13-7-11-23-10-5-6-12-25(23)26)19-27-16-14-22(15-17-27)18-21-8-3-2-4-9-21/h2-13,22,24H,14-20H2,1H3
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| InChIKey |
OMELHWVSRFASHO-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