2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid
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![2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/acdba09093574ce78a52616bc6ac3e74.png "2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid")
2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid
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CAS No:
70539-56-9
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Formula:
C21H24N8O5
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Chemical Name:
2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid
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Synonyms:
70539-56-9;NSC251706;CHEMBL3246858;DTXSID90312240;2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid;NSC-251706;Heptanedioic acid,4-diamino-6-pteridinyl)methyl]amino]benzoyl]amino]-, (.+-.)-
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CAS No:
2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]heptanedioic acid Basic Attributes
468.5 g/mol
468.18696590 g/mol
251706
DTXSID90312240
Computed Properties
Molecular Weight:468.5
XLogP3:-1.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:11
Exact Mass:468.18696590
Monoisotopic Mass:468.18696590
Topological Polar Surface Area:219
Heavy Atom Count:34
Complexity:705
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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