General Information of the Compound
Compound ID |
CP0314760
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Compound Name |
2-methylsulfonyl-N-propan-2-yl-N-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]benzenesulfonamide
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Structure |
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Formula |
C19H22F3NO5S2
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Molecular Weight |
465.515
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Canonical SMILES |
CC(C)N(c1ccc(cc1)C(C)(O)C(F)(F)F)S(=O)(=O)c1ccccc1S(C)(=O)=O
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InChI |
InChI=1S/C19H22F3NO5S2/c1-13(2)23(15-11-9-14(10-12-15)18(3,24)19(20,21)22)30(27,28)17-8-6-5-7-16(17)29(4,25)26/h5-13,24H,1-4H3
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InChIKey |
UJYRFOYKBGFQSN-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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