2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid
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![2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a0e558d983cc4ef699c3a266befb6950.png "2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid")
2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid
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CAS No:
70280-74-9
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Formula:
C21H22Cl2N8O5
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Chemical Name:
2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid
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Synonyms:
70280-74-9;NSC292229;DTXSID30330660;NSC-292229;2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid;L-Glutamic acid,5-dichloro-4-[[(2,4-diamino-6-pteridinyl)methyl]ethylamino]benzoyl]-
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CAS No:
2-[[3,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid Basic Attributes
537.4 g/mol
536.1090212 g/mol
292229
DTXSID30330660
Computed Properties
Molecular Weight:537.4
XLogP3:0.3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:10
Exact Mass:536.1090212
Monoisotopic Mass:536.1090212
Topological Polar Surface Area:211
Heavy Atom Count:36
Complexity:785
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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