2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid
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![2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b8abafd871c44be49b4e19c776566e26.png "2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid")
2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid
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CAS No:
76822-63-4
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Formula:
C20H20N6O5S
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Chemical Name:
2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid
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Synonyms:
76822-63-4;NSC344246;DTXSID60319367;NSC-344246;2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid;DS-002311;L-Glutamic acid,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]thio]benzoyl]-;L-Glutamic acid, N-[4-[[(2,4-diaminopyrido[3, 2-d]pyrimidin-6-yl)methyl]thio]benzoyl]-
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CAS No:
2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid Basic Attributes
456.5 g/mol
456.12158893 g/mol
344246
DTXSID60319367
Computed Properties
Molecular Weight:456.5
XLogP3:0.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:9
Exact Mass:456.12158893
Monoisotopic Mass:456.12158893
Topological Polar Surface Area:220
Heavy Atom Count:32
Complexity:677
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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