General Information of the Compound
| Compound ID |
CP0411106
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| Compound Name |
[4-(4-sulfamoyloxyphenyl)sulfanylphenyl] sulfamate
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| Structure |
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| Formula |
C12H12N2O6S3
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| Molecular Weight |
376.437
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| Canonical SMILES |
NS(=O)(=O)Oc1ccc(Sc2ccc(OS(N)(=O)=O)cc2)cc1
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| InChI |
InChI=1S/C12H12N2O6S3/c13-22(15,16)19-9-1-5-11(6-2-9)21-12-7-3-10(4-8-12)20-23(14,17)18/h1-8H,(H2,13,15,16)(H2,14,17,18)
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| InChIKey |
HRUVZHPJVFCBHT-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