General Information of the Compound
| Compound ID |
CP0411107
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| Compound Name |
[4-[(4-sulfamoyloxyphenyl)methyl]phenyl] sulfamate
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| Structure |
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| Formula |
C13H14N2O6S2
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| Molecular Weight |
358.397
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| Canonical SMILES |
NS(=O)(=O)Oc1ccc(Cc2ccc(OS(N)(=O)=O)cc2)cc1
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| InChI |
InChI=1S/C13H14N2O6S2/c14-22(16,17)20-12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)21-23(15,18)19/h1-8H,9H2,(H2,14,16,17)(H2,15,18,19)
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| InChIKey |
WCHSSCCMVWIXSK-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