General Information of the Compound
| Compound ID |
CP0673879
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| Compound Name |
sodium(methyl(phenyl)amino)methanesulfonate
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| Synonyms |
CHEMBL571598
Sodium N-methylphenylaminomethanesulfonate
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| Structure |
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| Formula |
C8H10NNaO3S
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| Molecular Weight |
223.229
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| Canonical SMILES |
CN(CS(=O)(=O)[O-])c1ccccc1.[Na+]
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| InChI |
InChI=1S/C8H11NO3S.Na/c1-9(7-13(10,11)12)8-5-3-2-4-6-8;/h2-6H,7H2,1H3,(H,10,11,12);/q;+1/p-1
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| InChIKey |
XIDHWXUDYZMZID-UHFFFAOYSA-M
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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: PT00841, Carbonic anhydrase 12
Protein ID: PT01011, Carbonic anhydrase 9
Clinical Information about the Compound