CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 128.7 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
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COMPUTED DESCRIPTORS
Molecular Weight | 194.23 g/mol |
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XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 194.094294304 g/mol |
Monoisotopic Mass | 194.094294304 g/mol |
Topological Polar Surface Area | 27.7 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 183 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |