2-[[4-[(7-amino-5-oxo-2,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
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![2-[[4-[(7-amino-5-oxo-2,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9876abf40cba4fb8a17e37140fbc1700.png "2-[[4-[(7-amino-5-oxo-2,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid")
2-[[4-[(7-amino-5-oxo-2,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
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CAS No:
52454-44-1
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Formula:
C21H24N6O6
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Chemical Name:
2-[[4-[(7-amino-5-oxo-2,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
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Synonyms:
NSC173962;52454-44-1;DTXSID90306063;NSC-173962
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CAS No:
2-[[4-[(7-amino-5-oxo-2,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid Basic Attributes
456.5 g/mol
456.17573251 g/mol
173962
DTXSID90306063
Computed Properties
Molecular Weight:456.5
XLogP3:-0.2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:456.17573251
Monoisotopic Mass:456.17573251
Topological Polar Surface Area:186
Heavy Atom Count:33
Complexity:918
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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