3-(1H-imidazol-5-yl)-2-sulfanylpropanoic acid
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3-(1H-imidazol-5-yl)-2-sulfanylpropanoic acid
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CAS No:
67047-27-2
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Formula:
C6H8N2O2S
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Chemical Name:
3-(1H-imidazol-5-yl)-2-sulfanylpropanoic acid
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Synonyms:
2-mercapto-3-(5-imidazolyl)propionic acid;67047-27-2;NSC315286;2-Mercapto-3-(5-imidazolyl)propionic acid;3-(1H-imidazol-5-yl)-2-sulfanylpropanoic acid;CHEMBL3302521;DTXSID30985992;NSC-315286;3-(1H-Imidazol-5-yl)-2-mercaptopropanoic acid;1H-Imidazole-4-propanoic acid, alpha-mercapto-, monohydrobromide, (+-)-
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CAS No:
3-(1H-imidazol-5-yl)-2-sulfanylpropanoic acid Basic Attributes
172.21 g/mol
172.03064868 g/mol
315286
Computed Properties
Molecular Weight:172.21
XLogP3:0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:172.03064868
Monoisotopic Mass:172.03064868
Topological Polar Surface Area:67
Heavy Atom Count:11
Complexity:154
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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