General Information of the Compound
| Compound ID |
CP0518070
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| Compound Name |
N-[1-[2-(2-methylphenoxy)ethyl]piperidin-4-yl]benzenesulfonamide
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| Structure |
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| Formula |
C20H26N2O3S
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| Molecular Weight |
374.506
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| Canonical SMILES |
Cc1ccccc1OCCN1CCC(CC1)NS(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C20H26N2O3S/c1-17-7-5-6-10-20(17)25-16-15-22-13-11-18(12-14-22)21-26(23,24)19-8-3-2-4-9-19/h2-10,18,21H,11-16H2,1H3
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| InChIKey |
LQPALYCPFVMKLA-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
Protein ID: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7