2-amino-5-[[1-(carboxymethylamino)-3-[(4-fluorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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![2-amino-5-[[1-(carboxymethylamino)-3-[(4-fluorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c989de4abf3147b2b6b4487f606bd543.png "2-amino-5-[[1-(carboxymethylamino)-3-[(4-fluorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid")
2-amino-5-[[1-(carboxymethylamino)-3-[(4-fluorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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CAS No:
33812-37-2
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Formula:
C17H22FN3O6S
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Chemical Name:
2-amino-5-[[1-(carboxymethylamino)-3-[(4-fluorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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Synonyms:
33812-37-2;NSC131119;SCHEMBL11873669;DTXSID80299511;NSC-131119;gamma-Glutamyl-S-[(4-fluorophenyl)methyl]cysteinylglycine
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CAS No:
2-amino-5-[[1-(carboxymethylamino)-3-[(4-fluorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Basic Attributes
415.4 g/mol
415.12133477 g/mol
131119
DTXSID80299511
Computed Properties
Molecular Weight:415.4
XLogP3:-2.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:12
Exact Mass:415.12133477
Monoisotopic Mass:415.12133477
Topological Polar Surface Area:184
Heavy Atom Count:28
Complexity:557
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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