179461-52-0
Product Name:
PD 151746
Formula:
C11H8FNO2S
Synonyms:
3-(5-Fluoro-1H-indol-3-yl)-2-mercapto-2-propenoic acid;3-(5-Fluoro-3-indolyl)-2-mercapto-(Z)-2-propenoic Acid;PD 151746 - CAS 179461-52-0 - Calbiochem
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COMPUTED DESCRIPTORS
| Molecular Weight | 237.25 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 237.02597783 g/mol |
| Monoisotopic Mass | 237.02597783 g/mol |
| Topological Polar Surface Area | 54.1 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 321 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |