General Information of the Compound
| Compound ID |
CP0496650
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| Compound Name |
2-(3-chloro-5-(4-(ethylcarbamoyl)-2-(phenylsulfonamido)phenoxy)phenyl)acetic acid
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| Structure |
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| Formula |
C23H21ClN2O6S
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| Molecular Weight |
488.949
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| Canonical SMILES |
CCNC(=O)c1ccc(Oc2cc(Cl)cc(CC(O)=O)c2)c(NS(=O)(=O)c2ccccc2)c1
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| InChI |
InChI=1S/C23H21ClN2O6S/c1-2-25-23(29)16-8-9-21(32-18-11-15(12-22(27)28)10-17(24)14-18)20(13-16)26-33(30,31)19-6-4-3-5-7-19/h3-11,13-14,26H,2,12H2,1H3,(H,25,29)(H,27,28)
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| InChIKey |
PAAMUZRSULOIPW-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