General Information of the Compound
| Compound ID |
CP0437196
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| Compound Name |
ethyl 5-[(3,4-dimethoxyphenyl)sulfonylamino]-3-methyl-1-benzofuran-2-carboxylate
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| Structure |
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| Formula |
C20H21NO7S
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| Molecular Weight |
419.455
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| Canonical SMILES |
CCOC(=O)c1oc2ccc(NS(=O)(=O)c3ccc(OC)c(OC)c3)cc2c1C
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| InChI |
InChI=1S/C20H21NO7S/c1-5-27-20(22)19-12(2)15-10-13(6-8-16(15)28-19)21-29(23,24)14-7-9-17(25-3)18(11-14)26-4/h6-11,21H,5H2,1-4H3
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| InChIKey |
VPDKAZOQYIOZHR-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