2-[[3-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
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![2-[[3-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5985c7a0f4a9472a9ace91db39df30f9.png "2-[[3-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid")
2-[[3-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
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CAS No:
29746-12-1
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Formula:
C21H22N6O5
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Chemical Name:
2-[[3-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
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Synonyms:
NSC121346;29746-12-1;NSC-121346
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CAS No:
2-[[3-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid Basic Attributes
438.4 g/mol
438.16516782 g/mol
121346
Computed Properties
Molecular Weight:438.4
XLogP3:1.1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:438.16516782
Monoisotopic Mass:438.16516782
Topological Polar Surface Area:194
Heavy Atom Count:32
Complexity:679
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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