750 AstraZeneca ELN dataset
查看IDENTITY
结构与身份
- 标准SMILES
- CN1CCC(Oc2cccc(N)c2)CC1
- InChIKey
- KEMAETWBRDLVRA-UHFFFAOYSA-N
- 分子式
- C12H18N2O
- 平均分子量
- 206.289 g/mol
- 单同位素质量
- 206.1419132
扩展信息尚未完成同步。
REACTIONS
参与反应
uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08541429B2
查看Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 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-2009_01 · 10.6084/m9.figshare.5104873.v1 · US07482354B2
查看uspto-grants-2009_10 · 10.6084/m9.figshare.5104873.v1 · US07608629B2
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