(2S)-3-methyl-2-[[2-[[2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl)oxy]acetyl]amino]acetyl]amino]butanoic acid
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(2S)-3-methyl-2-[[2-[[2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl)oxy]acetyl]amino]acetyl]amino]butanoic acid
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CAS No:
956047-16-8
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Formula:
C22H26N2O7
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Chemical Name:
(2S)-3-methyl-2-[[2-[[2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl)oxy]acetyl]amino]acetyl]amino]butanoic acid
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Synonyms:
ZINC2112482;AKOS030501579;MCULE-3557311126;(S)-3-methyl-2-(2-(2-((7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy)acetamido)acetamido)butanoic acid;956047-16-8
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CAS No:
(2S)-3-methyl-2-[[2-[[2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl)oxy]acetyl]amino]acetyl]amino]butanoic acid Basic Attributes
430.5 g/mol
430.17400117 g/mol
Computed Properties
Molecular Weight:430.5
XLogP3:2.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:430.17400117
Monoisotopic Mass:430.17400117
Topological Polar Surface Area:131
Heavy Atom Count:31
Complexity:776
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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