N-Methylethylamine → 6-[(5-{2-[ethyl(methyl)amino]ethoxy}pyridin-2-yl)oxy]-N-(1-methyl-1H-pyrazol-3-yl)quinazoline-4-amine
반응식
[CH2:1]([O:2][CH:4]([O:3][CH2:31][CH3:32])[CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]([O:13][c:14]2[cH:15][c:16]3[c:17]([NH:24][c:25]4[n:26][n:27]([CH3:30])[cH:28][cH:29]4)[n:18][cH:19][n:20][c:21]3[cH:22][cH:23]2)[n:11][cH:12]1)[CH3:33].[CH2:34]([CH3:35])[NH:36][CH3:37]>>[CH2:4]([CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]([O:13][c:14]2[cH:15][c:16]3[c:17]([NH:24][c:25]4[n:26][n:27]([CH3:30])[cH:28][cH:29]4)[n:18][cH:19][n:20][c:21]3[cH:22][cH:23]2)[n:11][cH:12]1)[N:36]([CH2:34][CH3:35])[CH3:37]참가 물질
3
출처 및 근거
- ORD 기록
- ord-c4f71afd11604f898f978a71213ce0d3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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