General Information of the Compound
| Compound ID |
CP0552087
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| Compound Name |
N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C16H10F9NO3S
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| Molecular Weight |
467.309
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| Canonical SMILES |
OC(c1ccc(cc1)N(C(F)(F)F)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C16H10F9NO3S/c17-14(18,19)13(27,15(20,21)22)10-6-8-11(9-7-10)26(16(23,24)25)30(28,29)12-4-2-1-3-5-12/h1-9,27H
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| InChIKey |
NVKWDEFHOMJOQR-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: PT01555, Oxysterols receptor LXR-alpha
Protein ID: PT01887, Oxysterols receptor LXR-beta