Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- O=C1Cc2c(cccc2-c2ccccc2F)N1
- InChIKey
- UYLGBZAYZVYXOQ-UHFFFAOYSA-N
- 分子式
- C14H10FNO
- 平均分子量
- 227.23 g/mol
- 单同位素质量
- 227.07464211
COMPUTED
结构计算性质
- XLogP
- 2.5
- 极性表面积
- 29.1 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 1
- 重原子
- 17
- 形式电荷
- 0
- 复杂度
- 307
ALIASES
名称与别名
SCHEMBL6321462UYLGBZAYZVYXOQ-UHFFFAOYSA-N4-(2-fluorophenyl)-1,3-dihydro-indol-2-one4-(2-fluoro-phenyl)-1,3-dihydro-indol-2-one
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-2005_03 · 10.6084/m9.figshare.5104873.v1 · US06861418B2
查看uspto-grants-2005_03 · 10.6084/m9.figshare.5104873.v1 · US06861418B2
查看uspto-grants-2005_03 · 10.6084/m9.figshare.5104873.v1 · US06861418B2
查看uspto-grants-2005_03 · 10.6084/m9.figshare.5104873.v1 · US06861418B2
查看