84424-74-8
Product Name:
3-(4-AMINO-5-OXO-3-THIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-6-YL)PROPANOIC ACID
Formula:
C6H8N4O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 216.22 g/mol |
|---|---|
| XLogP3 | -2.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 216.03171130 g/mol |
| Monoisotopic Mass | 216.03171130 g/mol |
| Topological Polar Surface Area | 140 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 327 |
| 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 |