HCID541878

2-[(2-Hydroxyphenyl)methylamino]propanoic acid

C10H13NO3195.21 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(NCc1ccccc1O)C(=O)O
InChIKey: OGCTZOZVPQSYDN-UHFFFAOYSA-N
分子式: C10H13NO3
平均分子量: 195.21 g/mol
单同位素质量: 195.08954328

COMPUTED

结构计算性质

已同步

XLogP: -0.8
极性表面积: 69.6 Å²
氢键供体: 3
氢键受体: 4
可旋转键: 4
重原子: 14
形式电荷: 0
复杂度: 196

ALIASES

名称与别名

共 14 条

Maybridge3_0049582-[(2-hydroxyphenyl)methylamino]propanoic acidN-(2-Hydroxybenzyl)alanine #SCHEMBL29242881OGCTZOZVPQSYDN-UHFFFAOYSA-NHMS1445B0857496-55-6CCG-50336AKOS010760668IDI1_0163452-(2-Hydroxybenzyl-amino)propanoic acid2-((2-Hydroxybenzyl)amino)propanoic acidSR-01000639721-1Z821060166

REACTIONS

相关反应

3 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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