(2S)-2-[[2,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
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![(2S)-2-[[2,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/abc12a508b1c411096f0600d7b457139.png "(2S)-2-[[2,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid")
(2S)-2-[[2,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
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CAS No:
151648-46-3
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Formula:
C20H20Cl2N8O5
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Chemical Name:
(2S)-2-[[2,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
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CAS No:
(2S)-2-[[2,5-dichloro-4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid Basic Attributes
523.32900
522.0933712 g/mol
5GCOIPOBMD
DTXSID40164832
Computed Properties
Molecular Weight:523.3
XLogP3:-0.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:522.0933712
Monoisotopic Mass:522.0933712
Topological Polar Surface Area:211
Heavy Atom Count:35
Complexity:782
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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