General Information of the Compound
| Compound ID |
CP0483566
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| Compound Name |
ethyl 3-methyl-5-(naphthalen-2-ylsulfonylamino)-1-benzofuran-2-carboxylate
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| Structure |
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| Formula |
C22H19NO5S
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| Molecular Weight |
409.463
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| Canonical SMILES |
CCOC(=O)c1oc2ccc(NS(=O)(=O)c3ccc4ccccc4c3)cc2c1C
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| InChI |
InChI=1S/C22H19NO5S/c1-3-27-22(24)21-14(2)19-13-17(9-11-20(19)28-21)23-29(25,26)18-10-8-15-6-4-5-7-16(15)12-18/h4-13,23H,3H2,1-2H3
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| InChIKey |
KOVXAWATCCSGOJ-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
Protein ID: PT02791, Hypoxia-inducible factor 1-alpha
Cell Viability or Cytotoxicity Assay