General Information of the Compound
| Compound ID |
CP0470982
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| Compound Name |
ethyl 1-(4-fluorophenyl)sulfonylindole-2-carboxylate
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| Structure |
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| Formula |
C17H14FNO4S
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| Molecular Weight |
347.367
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| Canonical SMILES |
CCOC(=O)c1cc2ccccc2n1S(=O)(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C17H14FNO4S/c1-2-23-17(20)16-11-12-5-3-4-6-15(12)19(16)24(21,22)14-9-7-13(18)8-10-14/h3-11H,2H2,1H3
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| InChIKey |
YJBUILPMZASESQ-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: PT03645, Nucleotide-binding oligomerization domain-containing protein 1
Protein ID: PT03970, Nucleotide-binding oligomerization domain-containing protein 2