General Information of the Compound
| Compound ID |
CP0362715
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| Compound Name |
1-Benzyl-4-[3-(methylsulfonyl)phenyl]piperidine
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| Synonyms |
1-Benzyl-4-[3-(methylsulfonyl)phenyl]piperidine
CHEMBL596800
SCHEMBL4825273
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| Structure |
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| Formula |
C19H23NO2S
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| Molecular Weight |
329.465
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| Canonical SMILES |
CS(=O)(=O)c1cccc(c1)C1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C19H23NO2S/c1-23(21,22)19-9-5-8-18(14-19)17-10-12-20(13-11-17)15-16-6-3-2-4-7-16/h2-9,14,17H,10-13,15H2,1H3
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| InChIKey |
KOPPWFMKOOMORI-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