apratastat
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apratastat
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CAS No:
287405-51-0
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Formula:
C17H22N2O6S2
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Chemical Name:
apratastat
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Synonyms:
4-((4-(2-butynyloxy)phenyl)sulfonyl)-N-hydroxy-2,2-dimethyl-(3S)thiomorpholinecarboxamide;apratastat;TMI 005;TMI-005;TMI-1;TMI-05;UNII-C6BZ5263BJ
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CAS No:
Description
Apratastat is a sulfonamide.|Tmi 005 is under investigation in clinical trial NCT00095342 (Study Evaluating TMI-005 in Active Rheumatoid Arthritis).
Drug Information
4-((4-(2-butynyloxy)phenyl)sulfonyl)-N-hydroxy-2,2-dimethyl-(3S)thiomorpholinecarboxamide
Computed Properties
Molecular Weight:414.5
XLogP3:0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:414.09192877
Monoisotopic Mass:414.09192877
Topological Polar Surface Area:150
Heavy Atom Count:27
Complexity:683
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes