General Information of the Compound
| Compound ID |
CP0511149
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| Compound Name |
N-[1-[2-(2-cyclopentylphenoxy)ethyl]piperidin-4-yl]-4-fluorobenzenesulfonamide
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| Structure |
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| Formula |
C24H31FN2O3S
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| Molecular Weight |
446.588
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| Canonical SMILES |
Fc1ccc(cc1)S(=O)(=O)NC1CCN(CCOc2ccccc2C2CCCC2)CC1
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| InChI |
InChI=1S/C24H31FN2O3S/c25-20-9-11-22(12-10-20)31(28,29)26-21-13-15-27(16-14-21)17-18-30-24-8-4-3-7-23(24)19-5-1-2-6-19/h3-4,7-12,19,21,26H,1-2,5-6,13-18H2
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| InChIKey |
QKJBJWSJKXMAOF-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