General Information of the Compound
| Compound ID |
CP0497215
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| Compound Name |
1-[3-[1-(benzenesulfonyl)cyclobutyl]propyl]piperidine
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| Structure |
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| Formula |
C18H27NO2S
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| Molecular Weight |
321.486
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| Canonical SMILES |
O=S(=O)(c1ccccc1)C1(CCCN2CCCCC2)CCC1
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| InChI |
InChI=1S/C18H27NO2S/c20-22(21,17-9-3-1-4-10-17)18(11-7-12-18)13-8-16-19-14-5-2-6-15-19/h1,3-4,9-10H,2,5-8,11-16H2
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| InChIKey |
RNJPOPKOYSPZHF-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