4-[[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]methyl]cyclohexane-1-carboxylic acid
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![4-[[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]methyl]cyclohexane-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/23f02bd7ee214c46ab2641d1eb18f05a.png "4-[[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]methyl]cyclohexane-1-carboxylic acid")
4-[[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]methyl]cyclohexane-1-carboxylic acid
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CAS No:
1173683-73-2
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Formula:
C18H32N2O5
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Chemical Name:
4-[[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]methyl]cyclohexane-1-carboxylic acid
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Synonyms:
STK576937;AKOS005501160;ZINC101281777;ZINC245325956;MCULE-3666381432;trans-4-({[N-(tert-butoxycarbonyl)-L-valyl]amino}methyl)cyclohexanecarboxylic acid;1173683-73-2
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CAS No:
4-[[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]methyl]cyclohexane-1-carboxylic acid Basic Attributes
356.5 g/mol
356.23112213 g/mol
Computed Properties
Molecular Weight:356.5
XLogP3:2.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:356.23112213
Monoisotopic Mass:356.23112213
Topological Polar Surface Area:105
Heavy Atom Count:25
Complexity:476
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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