General Information of the Compound
| Compound ID |
CP0458179
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| Compound Name |
N-[4-(oxan-4-ylmethoxy)-3-sulfamoylphenyl]-2-[2-(trifluoromethyl)phenyl]acetamide
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| Structure |
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| Formula |
C21H23F3N2O5S
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| Molecular Weight |
472.485
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| Canonical SMILES |
NS(=O)(=O)c1cc(NC(=O)Cc2ccccc2C(F)(F)F)ccc1OCC1CCOCC1
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| InChI |
InChI=1S/C21H23F3N2O5S/c22-21(23,24)17-4-2-1-3-15(17)11-20(27)26-16-5-6-18(19(12-16)32(25,28)29)31-13-14-7-9-30-10-8-14/h1-6,12,14H,7-11,13H2,(H,26,27)(H2,25,28,29)
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| InChIKey |
VDPNUILRGZIBBT-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