General Information of the Compound
| Compound ID |
CP0502785
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| Compound Name |
2-(3-(4-(ethylcarbamoyl)-2-(4-methylphenylsulfonamido)phenoxy)phenyl)acetic acid
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| Structure |
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| Formula |
C24H24N2O6S
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| Molecular Weight |
468.531
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| Canonical SMILES |
CCNC(=O)c1ccc(Oc2cccc(CC(O)=O)c2)c(NS(=O)(=O)c2ccc(C)cc2)c1
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| InChI |
InChI=1S/C24H24N2O6S/c1-3-25-24(29)18-9-12-22(32-19-6-4-5-17(13-19)14-23(27)28)21(15-18)26-33(30,31)20-10-7-16(2)8-11-20/h4-13,15,26H,3,14H2,1-2H3,(H,25,29)(H,27,28)
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| InChIKey |
JMXZKNGEIWCMJY-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