General Information of the Compound
| Compound ID |
CP0475055
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| Compound Name |
2-(3-(4-acetyl-2-(phenylsulfonamido)phenoxy)phenyl)acetic acid
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| Structure |
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| Formula |
C22H19NO6S
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| Molecular Weight |
425.462
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| Canonical SMILES |
CC(=O)c1ccc(Oc2cccc(CC(O)=O)c2)c(NS(=O)(=O)c2ccccc2)c1
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| InChI |
InChI=1S/C22H19NO6S/c1-15(24)17-10-11-21(29-18-7-5-6-16(12-18)13-22(25)26)20(14-17)23-30(27,28)19-8-3-2-4-9-19/h2-12,14,23H,13H2,1H3,(H,25,26)
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| InChIKey |
SGGGHTSFSWEZKS-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