2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]-4-sulfobutanoic acid
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![2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]-4-sulfobutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9f30c7fb5681434aa28ead09d48d1d65.png "2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]-4-sulfobutanoic acid")
2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]-4-sulfobutanoic acid
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CAS No:
96193-19-0
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Formula:
C18H20N8O6S
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Chemical Name:
2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]-4-sulfobutanoic acid
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Synonyms:
CHEMBL281936;96193-19-0;DTXSID40914617;BDBM50023710;2-((4-(((2,4-Diaminopteridin-6-yl)methyl)amino)phenyl)carbonylamino)-4-sulfobutanoic acid;2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-amino]-benzoylamino}-4-sulfo-butyric acid;2-(4-{[(4-Amino-2-imino-2,3-dihydropteridin-6-yl)methyl]amino}benzamido)-4-sulfobutanoic acid
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CAS No:
2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]-4-sulfobutanoic acid Basic Attributes
476.5 g/mol
476.12265156 g/mol
Computed Properties
Molecular Weight:476.5
XLogP3:-2.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:9
Exact Mass:476.12265156
Monoisotopic Mass:476.12265156
Topological Polar Surface Area:245
Heavy Atom Count:33
Complexity:787
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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