General Information of the Compound
| Compound ID |
CP0460496
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| Compound Name |
C,C,C-Trifluoro-N-[3-((S)-1-propyl-piperidin-3-yl)-phenyl]-methanesulfonamide
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| Structure |
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| Formula |
C15H21F3N2O2S
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| Molecular Weight |
350.406
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| Canonical SMILES |
CCCN1CCC[C@H](C1)c1cccc(NS(=O)(=O)C(F)(F)F)c1
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| InChI |
InChI=1S/C15H21F3N2O2S/c1-2-8-20-9-4-6-13(11-20)12-5-3-7-14(10-12)19-23(21,22)15(16,17)18/h3,5,7,10,13,19H,2,4,6,8-9,11H2,1H3/t13-/m1/s1
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| InChIKey |
SWFXFUUQMZDQAK-CYBMUJFWSA-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: PT01448, 5-hydroxytryptamine receptor 1A
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor