(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoic acid
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(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoic acid
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CAS No:
957043-98-0
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Formula:
C20H19N3O5
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Chemical Name:
(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoic acid
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Synonyms:
ZINC2126210;STL546618;AKOS032428390;MCULE-3307100862;N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-L-tryptophan;957043-98-0
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CAS No:
(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoic acid Basic Attributes
381.4 g/mol
381.13247072 g/mol
Computed Properties
Molecular Weight:381.4
XLogP3:1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:381.13247072
Monoisotopic Mass:381.13247072
Topological Polar Surface Area:113
Heavy Atom Count:28
Complexity:574
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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