2411819-82-2
Product Name:
1H-Pyrrole-2-carboxamide, N-[(1S)-2-amino-1-[5-(hydroxymethyl)-2-thiazolyl]ethyl]-3-methyl-5-[5-(trifluoromethyl)-2-pyridinyl]-
Formula:
C18H18F3N5O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 425.4 g/mol |
|---|---|
| XLogP3 | 1 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Exact Mass | 425.11333049 g/mol |
| Monoisotopic Mass | 425.11333049 g/mol |
| Topological Polar Surface Area | 145 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 570 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |