uspto-grants-2013_07 · 10.6084/m9.figshare.5104873.v1 · US08497368B2
查看IDENTITY
结构与身份
- 标准SMILES
- Cn1ncc2cc(C(=O)c3cnc4ccc(Cl)nn34)ccc21
- InChIKey
- UTKYDOINMHCLGB-UHFFFAOYSA-N
- 分子式
- C15H10ClN5O
- 平均分子量
- 311.72 g/mol
- 单同位素质量
- 311.0573877
COMPUTED
结构计算性质
- XLogP
- 2.6
- 极性表面积
- 65.1 Ų
- 氢键供体
- 0
- 氢键受体
- 4
- 可旋转键
- 2
- 重原子
- 22
- 形式电荷
- 0
- 复杂度
- 450
ALIASES
名称与别名
(6-Chloroimidazo[1,2-b]pyridazin-3-yl)(1-methyl-1H-indazol-5-yl)methanone1266238-34-9SCHEMBL1163561UTKYDOINMHCLGB-UHFFFAOYSA-NDB-327871
REACTIONS
参与反应
uspto-grants-2013_07 · 10.6084/m9.figshare.5104873.v1 · US08497368B2
查看Training data from https://doi.org/10.1039/C8SC04228D (1/10) · 10.1039/C8SC04228D
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查看uspto-grants-2013_04 · 10.6084/m9.figshare.5104873.v1 · US08410264B2
查看Training data from https://doi.org/10.1039/C8SC04228D (10/10) · 10.1039/C8SC04228D
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