General Information of the Compound
| Compound ID |
CP0457708
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| Compound Name |
N-[4-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C21H24F3N3O3S
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| Molecular Weight |
455.502
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| Canonical SMILES |
CC(C)N1CCN(CC1)S(=O)(=O)c1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C21H24F3N3O3S/c1-15(2)26-10-12-27(13-11-26)31(29,30)19-8-6-18(7-9-19)25-20(28)16-4-3-5-17(14-16)21(22,23)24/h3-9,14-15H,10-13H2,1-2H3,(H,25,28)
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| InChIKey |
PWIYPVAYSYHZKP-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: PT04567, Transient receptor potential cation channel subfamily V member 4
Protein ID: PT03081, Transient receptor potential cation channel subfamily V member 4