General Information of the Compound
| Compound ID |
CP0683568
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| Compound Name |
2-fluoro-N-(1-(2-(2-isopropylphenoxy)ethyl)piperidin-4-yl)benzenesulfonamide
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| Structure |
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| Formula |
C22H29FN2O3S
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| Molecular Weight |
420.55
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| Canonical SMILES |
CC(C)c1ccccc1OCCN1CCC(NS(=O)(=O)c2ccccc2F)CC1
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| InChI |
InChI=1S/C22H29FN2O3S/c1-17(2)19-7-3-5-9-21(19)28-16-15-25-13-11-18(12-14-25)24-29(26,27)22-10-6-4-8-20(22)23/h3-10,17-18,24H,11-16H2,1-2H3
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| InChIKey |
HTXCEVIRYDTYBS-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: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT01005, D(2) dopamine receptor