General Information of the Compound
| Compound ID |
CP0266617
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| Compound Name |
N-cyclopropyl-N-[1-[4-(trifluoromethoxy)benzoyl]piperidin-4-yl]-3-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C23H22F6N2O4S
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| Molecular Weight |
536.494
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| Canonical SMILES |
FC(F)(F)Oc1ccc(cc1)C(=O)N1CCC(CC1)N(C1CC1)S(=O)(=O)c1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C23H22F6N2O4S/c24-22(25,26)16-2-1-3-20(14-16)36(33,34)31(17-6-7-17)18-10-12-30(13-11-18)21(32)15-4-8-19(9-5-15)35-23(27,28)29/h1-5,8-9,14,17-18H,6-7,10-13H2
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| InChIKey |
VSHHDVGDRNITCO-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