uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07087603B2
查看IDENTITY
结构与身份
- 标准SMILES
- Cc1cc(Nc2nc(Cl)nc3ccccc23)[nH]n1
- InChIKey
- GWEOBKYRGURQCQ-UHFFFAOYSA-N
- 分子式
- C12H10ClN5
- 平均分子量
- 259.69 g/mol
- 单同位素质量
- 259.062473
COMPUTED
结构计算性质
- XLogP
- 3.4
- 极性表面积
- 66.5 Ų
- 氢键供体
- 2
- 氢键受体
- 4
- 可旋转键
- 2
- 重原子
- 18
- 形式电荷
- 0
- 复杂度
- 290
ALIASES
名称与别名
404828-30-4SCHEMBL785406SCHEMBL2206599SCHEMBL301472532-chloro-n-(5-methyl-1h-pyrazol-3-yl)quinazolin-4-amineGWEOBKYRGURQCQ-UHFFFAOYSA-NDB-3238112-chloro-quinazolin-4-yl(5-methyl-1H-pyrazol-3-yl)-amine(2-chloro-quinazolin-4-yl)-(5-methyl-1H-pyrazol-3-yl)-amine(2-chloroquinazolin-4-yl)-(5-methyl-2H-pyrazol-3-yl)-amine
REACTIONS
参与反应
uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07087603B2
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查看uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07087603B2
查看Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看uspto-grants-2003_12 · 10.6084/m9.figshare.5104873.v1 · US06664247B2
查看uspto-grants-2003_12 · 10.6084/m9.figshare.5104873.v1 · US06664247B2
查看uspto-grants-2003_12 · 10.6084/m9.figshare.5104873.v1 · US06664247B2
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