Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- Nc1cc(F)cc2c1NC(=O)C2
- InChIKey
- DIFFVSPISVQLKF-UHFFFAOYSA-N
- 分子式
- C8H7FN2O
- 平均分子量
- 166.15 g/mol
- 单同位素质量
- 166.05424101
COMPUTED
结构计算性质
- XLogP
- 0.2
- 极性表面积
- 55.1 Ų
- 氢键供体
- 2
- 氢键受体
- 3
- 可旋转键
- 0
- 重原子
- 12
- 形式电荷
- 0
- 复杂度
- 209
ALIASES
名称与别名
7-Amino-5-fluoroindolin-2-one945381-62-47-amino-5-fluoro-1,3-dihydroindol-2-oneMFCD131933597-Amino-5-fluoro-1,3-dihydro-2H-indol-2-one7-amino-5-fluoro-1,3-dihydro-indol-2-oneSCHEMBL151642DTXSID90731336DIFFVSPISVQLKF-UHFFFAOYSA-NAKOS016007571DS-2605SB66111FA104789SY1058155-fluoro-7-amino-1,3-dihydro-indol-2-one7-amino-5-fluoro-1,3-dihydro-indole-2-oneCS-01500777-amino-5-fluoro-2,3-dihydro-1H-indol-2-oneF233258
REACTIONS
参与反应
Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-2011_09 · 10.6084/m9.figshare.5104873.v1 · US08012966B2
查看uspto-grants-2011_09 · 10.6084/m9.figshare.5104873.v1 · US08012966B2
查看uspto-grants-2011_09 · 10.6084/m9.figshare.5104873.v1 · US08012966B2
查看uspto-grants-2011_09 · 10.6084/m9.figshare.5104873.v1 · US08012966B2
查看Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D
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