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Chemical Information
N-[3-(aminomethyl)benzyl]acetamidine is an aralkylamine that is Nbenzylacetamidine substituted at position 3 on the benzene ring by an aminomethyl group. An inhibitor of nitric oxide synthase. It has a role as a geroprotector, an angiogenesis inhibitor and an EC 1.14.13.39 (nitric oxide synthase) inhibitor. It is an aralkylamine, a carboxamidine and a primary amino compound.
| CAS Number | 180001-34-7 |
| PubChem CID | 1433 |
| IUPAC Name | N'-[[3-(aminomethyl)phenyl]methyl]ethanimidamide |
| Molecular Formula | C10H15N3 |
| Molecular Weight | 177.25 |
| XLogP | -0.2 |
| Topological Polar Surface Area | 64.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 177 |
| Property | Value |
|---|---|
| Molecular Weight | 177.25 |
| XLogP3 | -0.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 177.126597491 |
| Monoisotopic Mass | 177.126597491 |
| Topological Polar Surface Area | 64.4 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 177 |
| 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 |
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