General Information of the Compound
| Compound ID |
CP0371728
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| Compound Name |
N-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]butan-2-yl]naphthalene-2-sulfonamide
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| Structure |
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| Formula |
C25H28F3N3O2S
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| Molecular Weight |
491.579
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| Canonical SMILES |
CC(CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)NS(=O)(=O)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C25H28F3N3O2S/c1-19(29-34(32,33)24-10-9-20-5-2-3-6-21(20)17-24)11-12-30-13-15-31(16-14-30)23-8-4-7-22(18-23)25(26,27)28/h2-10,17-19,29H,11-16H2,1H3
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| InChIKey |
DPYUFQCUTCRCNH-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT00941, 5-hydroxytryptamine receptor 7